YANO-5,10,15,20-TETRAPHENYLPORPHYRINATO)-NICKEL(N) DIMETHANOL SOLVATE

Citation
H. Duval et al., YANO-5,10,15,20-TETRAPHENYLPORPHYRINATO)-NICKEL(N) DIMETHANOL SOLVATE, Acta crystallographica. Section C, Crystal structure communications, 53, 1997, pp. 1027-1029
Citations number
11
Categorie Soggetti
Crystallography
ISSN journal
01082701
Volume
53
Year of publication
1997
Part
8
Pages
1027 - 1029
Database
ISI
SICI code
0108-2701(1997)53:<1027:YDS>2.0.ZU;2-4
Abstract
The title compound, [Ni(C48H24N8)(C5H5N)(2)].2CH(4)O, is a high-spin b is(pyridine)-Ni-II derivative of an antipodally beta-pyrrole-tetracyan o-substituted meso-tetraphenylporphyrin. The [Ni(py)2{tpp(CN)(4)}] mol ecule [py is pyridine and tpp(CN)(4) is ,18-tetracyano-5,10,15,20-tetr aphenylporphyrinato] lies on a crystallographic centre of symmetry, bu t its non-crystallographic symmetry is close to D-2h. The core of the tpp(CN)(4), porphyrin dianion is essentially planar. The high-spin sta te of the Ni-II cation leads to a lengthening of the Ni-N(pyrrole) bon d distances relative to those present in the low-spin [Ni(II)tpp] deri vative. Moreover, the electron-withdrawing beta-pyrrole cyano substitu ents, which lie in the antipodal pyrrolic rings, cause an increase in the C7-C8 and the antipodal C7'-C8' bond distances as well as an openi ng of the C6-N2-C9 and the antipodal C6'-N2'-C9' bond angles.