{6,6'-Dimeth-oxy-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methyl-idyne)]diphenolato}nickel(II) 1.78-hydrate.
Identifieur interne : 001E68 ( PubMed/Checkpoint ); précédent : 001E67; suivant : 001E69{6,6'-Dimeth-oxy-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methyl-idyne)]diphenolato}nickel(II) 1.78-hydrate.
Auteurs : Chin Sing Yeap ; Reza Kia ; Hadi Kargar ; Hoong-Kun FunSource :
- Acta crystallographica. Section E, Structure reports online [ 1600-5368 ] ; 2009.
Abstract
In the title complex, [Ni(C(21)H(24)N(2)O(4))]·1.78H(2)O, the Ni(II) ion has a slightly distorted planar geometry, coordinated by the two N and two O atoms of the tetra-dentate Schiff base ligand, with a mean deviation of 0.272 Å from the NiN(2)O(2) plane. The N and O donor atoms are mutually cis. The dihedral angle between two benzene rings of the ligand is 38.86 (8)°. There are also three solvent water mol-ecules, two of which lie across different crystallographic twofold rotation axes; one of these is partially occupied with a refined occupancy factor of 0.570 (7). The water mol-ecules are linked together as tetra-mers in R(2) (2)(8) ring motifs, which also connect two neighbouring mol-ecules of the complex through a network of O-H⋯O hydrogen bonds. The crystal structure is further stabilized by inter-molecular C-H⋯O and C-H⋯π inter-actions, which link neighbouring mol-ecules into extended chains along the b axis. Other inter-esting features of the crystal structure are the short inter-molecular C⋯C [3.204 (3)-3.365 (3) Å] and the C⋯O [3.199 (2)-3.205 (2) Å] contacts which are shorter than the sum of the van der Waals radii of these atoms.
DOI: 10.1107/S1600536809014500
PubMed: 21583800
Affiliations:
Links toward previous steps (curation, corpus...)
Links to Exploration step
pubmed:21583800Le document en format XML
<record><TEI><teiHeader><fileDesc><titleStmt><title xml:lang="en">{6,6'-Dimeth-oxy-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methyl-idyne)]diphenolato}nickel(II) 1.78-hydrate.</title><author><name sortKey="Yeap, Chin Sing" sort="Yeap, Chin Sing" uniqKey="Yeap C" first="Chin Sing" last="Yeap">Chin Sing Yeap</name></author><author><name sortKey="Kia, Reza" sort="Kia, Reza" uniqKey="Kia R" first="Reza" last="Kia">Reza Kia</name></author><author><name sortKey="Kargar, Hadi" sort="Kargar, Hadi" uniqKey="Kargar H" first="Hadi" last="Kargar">Hadi Kargar</name></author><author><name sortKey="Fun, Hoong Kun" sort="Fun, Hoong Kun" uniqKey="Fun H" first="Hoong-Kun" last="Fun">Hoong-Kun Fun</name></author></titleStmt><publicationStmt><idno type="wicri:source">PubMed</idno><date when="2009">2009</date><idno type="RBID">pubmed:21583800</idno><idno type="pmid">21583800</idno><idno type="doi">10.1107/S1600536809014500</idno><idno type="wicri:Area/PubMed/Corpus">002043</idno><idno type="wicri:explorRef" wicri:stream="PubMed" wicri:step="Corpus" wicri:corpus="PubMed">002043</idno><idno type="wicri:Area/PubMed/Curation">002043</idno><idno type="wicri:explorRef" wicri:stream="PubMed" wicri:step="Curation">002043</idno><idno type="wicri:Area/PubMed/Checkpoint">001E68</idno><idno type="wicri:explorRef" wicri:stream="Checkpoint" wicri:step="PubMed">001E68</idno></publicationStmt><sourceDesc><biblStruct><analytic><title xml:lang="en">{6,6'-Dimeth-oxy-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methyl-idyne)]diphenolato}nickel(II) 1.78-hydrate.</title><author><name sortKey="Yeap, Chin Sing" sort="Yeap, Chin Sing" uniqKey="Yeap C" first="Chin Sing" last="Yeap">Chin Sing Yeap</name></author><author><name sortKey="Kia, Reza" sort="Kia, Reza" uniqKey="Kia R" first="Reza" last="Kia">Reza Kia</name></author><author><name sortKey="Kargar, Hadi" sort="Kargar, Hadi" uniqKey="Kargar H" first="Hadi" last="Kargar">Hadi Kargar</name></author><author><name sortKey="Fun, Hoong Kun" sort="Fun, Hoong Kun" uniqKey="Fun H" first="Hoong-Kun" last="Fun">Hoong-Kun Fun</name></author></analytic><series><title level="j">Acta crystallographica. Section E, Structure reports online</title><idno type="ISSN">1600-5368</idno><imprint><date when="2009" type="published">2009</date></imprint></series></biblStruct></sourceDesc></fileDesc><profileDesc><textClass></textClass></profileDesc></teiHeader><front><div type="abstract" xml:lang="en">In the title complex, [Ni(C(21)H(24)N(2)O(4))]·1.78H(2)O, the Ni(II) ion has a slightly distorted planar geometry, coordinated by the two N and two O atoms of the tetra-dentate Schiff base ligand, with a mean deviation of 0.272 Å from the NiN(2)O(2) plane. The N and O donor atoms are mutually cis. The dihedral angle between two benzene rings of the ligand is 38.86 (8)°. There are also three solvent water mol-ecules, two of which lie across different crystallographic twofold rotation axes; one of these is partially occupied with a refined occupancy factor of 0.570 (7). The water mol-ecules are linked together as tetra-mers in R(2) (2)(8) ring motifs, which also connect two neighbouring mol-ecules of the complex through a network of O-H⋯O hydrogen bonds. The crystal structure is further stabilized by inter-molecular C-H⋯O and C-H⋯π inter-actions, which link neighbouring mol-ecules into extended chains along the b axis. Other inter-esting features of the crystal structure are the short inter-molecular C⋯C [3.204 (3)-3.365 (3) Å] and the C⋯O [3.199 (2)-3.205 (2) Å] contacts which are shorter than the sum of the van der Waals radii of these atoms.</div></front></TEI><pubmed><MedlineCitation Status="PubMed-not-MEDLINE" Owner="NLM"><PMID Version="1">21583800</PMID><DateCompleted><Year>2011</Year><Month>07</Month><Day>14</Day></DateCompleted><DateRevised><Year>2018</Year><Month>11</Month><Day>13</Day></DateRevised><Article PubModel="Electronic"><Journal><ISSN IssnType="Print">1600-5368</ISSN><JournalIssue CitedMedium="Print"><Volume>65</Volume><Issue>Pt 5</Issue><PubDate><Year>2009</Year><Month>Apr</Month><Day>25</Day></PubDate></JournalIssue><Title>Acta crystallographica. Section E, Structure reports online</Title><ISOAbbreviation>Acta Crystallogr Sect E Struct Rep Online</ISOAbbreviation></Journal><ArticleTitle>{6,6'-Dimeth-oxy-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methyl-idyne)]diphenolato}nickel(II) 1.78-hydrate.</ArticleTitle><Pagination><MedlinePgn>m570-1</MedlinePgn></Pagination><ELocationID EIdType="doi" ValidYN="Y">10.1107/S1600536809014500</ELocationID><Abstract><AbstractText>In the title complex, [Ni(C(21)H(24)N(2)O(4))]·1.78H(2)O, the Ni(II) ion has a slightly distorted planar geometry, coordinated by the two N and two O atoms of the tetra-dentate Schiff base ligand, with a mean deviation of 0.272 Å from the NiN(2)O(2) plane. The N and O donor atoms are mutually cis. The dihedral angle between two benzene rings of the ligand is 38.86 (8)°. There are also three solvent water mol-ecules, two of which lie across different crystallographic twofold rotation axes; one of these is partially occupied with a refined occupancy factor of 0.570 (7). The water mol-ecules are linked together as tetra-mers in R(2) (2)(8) ring motifs, which also connect two neighbouring mol-ecules of the complex through a network of O-H⋯O hydrogen bonds. The crystal structure is further stabilized by inter-molecular C-H⋯O and C-H⋯π inter-actions, which link neighbouring mol-ecules into extended chains along the b axis. Other inter-esting features of the crystal structure are the short inter-molecular C⋯C [3.204 (3)-3.365 (3) Å] and the C⋯O [3.199 (2)-3.205 (2) Å] contacts which are shorter than the sum of the van der Waals radii of these atoms.</AbstractText></Abstract><AuthorList CompleteYN="Y"><Author ValidYN="Y"><LastName>Yeap</LastName><ForeName>Chin Sing</ForeName><Initials>CS</Initials></Author><Author ValidYN="Y"><LastName>Kia</LastName><ForeName>Reza</ForeName><Initials>R</Initials></Author><Author ValidYN="Y"><LastName>Kargar</LastName><ForeName>Hadi</ForeName><Initials>H</Initials></Author><Author ValidYN="Y"><LastName>Fun</LastName><ForeName>Hoong-Kun</ForeName><Initials>HK</Initials></Author></AuthorList><Language>eng</Language><PublicationTypeList><PublicationType UI="D016428">Journal Article</PublicationType></PublicationTypeList><ArticleDate DateType="Electronic"><Year>2009</Year><Month>04</Month><Day>25</Day></ArticleDate></Article><MedlineJournalInfo><Country>United States</Country><MedlineTA>Acta Crystallogr Sect E Struct Rep Online</MedlineTA><NlmUniqueID>101089178</NlmUniqueID><ISSNLinking>1600-5368</ISSNLinking></MedlineJournalInfo></MedlineCitation><PubmedData><History><PubMedPubDate PubStatus="received"><Year>2009</Year><Month>04</Month><Day>16</Day></PubMedPubDate><PubMedPubDate PubStatus="accepted"><Year>2009</Year><Month>04</Month><Day>18</Day></PubMedPubDate><PubMedPubDate PubStatus="entrez"><Year>2011</Year><Month>5</Month><Day>18</Day><Hour>6</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="pubmed"><Year>2009</Year><Month>1</Month><Day>1</Day><Hour>0</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="medline"><Year>2009</Year><Month>1</Month><Day>1</Day><Hour>0</Hour><Minute>1</Minute></PubMedPubDate></History><PublicationStatus>epublish</PublicationStatus><ArticleIdList><ArticleId IdType="pubmed">21583800</ArticleId><ArticleId IdType="doi">10.1107/S1600536809014500</ArticleId><ArticleId IdType="pmc">PMC2977614</ArticleId></ArticleIdList><ReferenceList><Reference><Citation>Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22</Citation><ArticleIdList><ArticleId IdType="pubmed">18156677</ArticleId></ArticleIdList></Reference><Reference><Citation>Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55</Citation><ArticleIdList><ArticleId IdType="pubmed">19171970</ArticleId></ArticleIdList></Reference><Reference><Citation>Anal Chem. 2000 Mar 1;72(5):956-62</Citation><ArticleIdList><ArticleId IdType="pubmed">10739198</ArticleId></ArticleIdList></Reference><Reference><Citation>Acta Crystallogr C. 2000 Apr;56 (Pt 4):423-4</Citation><ArticleIdList><ArticleId IdType="pubmed">10815194</ArticleId></ArticleIdList></Reference></ReferenceList></PubmedData></pubmed><affiliations><list></list><tree><noCountry><name sortKey="Fun, Hoong Kun" sort="Fun, Hoong Kun" uniqKey="Fun H" first="Hoong-Kun" last="Fun">Hoong-Kun Fun</name><name sortKey="Kargar, Hadi" sort="Kargar, Hadi" uniqKey="Kargar H" first="Hadi" last="Kargar">Hadi Kargar</name><name sortKey="Kia, Reza" sort="Kia, Reza" uniqKey="Kia R" first="Reza" last="Kia">Reza Kia</name><name sortKey="Yeap, Chin Sing" sort="Yeap, Chin Sing" uniqKey="Yeap C" first="Chin Sing" last="Yeap">Chin Sing Yeap</name></noCountry></tree></affiliations></record>Pour manipuler ce document sous Unix (Dilib)
EXPLOR_STEP=$WICRI_ROOT/Sante/explor/MersV1/Data/PubMed/Checkpoint
HfdSelect -h $EXPLOR_STEP/biblio.hfd -nk 001E68 | SxmlIndent | more
Ou
HfdSelect -h $EXPLOR_AREA/Data/PubMed/Checkpoint/biblio.hfd -nk 001E68 | SxmlIndent | more
Pour mettre un lien sur cette page dans le réseau Wicri
{{Explor lien
|wiki= Sante
|area= MersV1
|flux= PubMed
|étape= Checkpoint
|type= RBID
|clé= pubmed:21583800
|texte= {6,6'-Dimeth-oxy-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methyl-idyne)]diphenolato}nickel(II) 1.78-hydrate.
}}
Pour générer des pages wiki
HfdIndexSelect -h $EXPLOR_AREA/Data/PubMed/Checkpoint/RBID.i -Sk "pubmed:21583800" \
| HfdSelect -Kh $EXPLOR_AREA/Data/PubMed/Checkpoint/biblio.hfd \
| NlmPubMed2Wicri -a MersV1
| This area was generated with Dilib version V0.6.33. |  |