Why does the yellow isomer of [Sn{PPh2Se)(2)-Se,Se ')}(2)] present a square planar four-co-ordinated tin(II)? A molecular orbital approach

Citation
I. Silaghi-dumitrescu et al., Why does the yellow isomer of [Sn{PPh2Se)(2)-Se,Se ')}(2)] present a square planar four-co-ordinated tin(II)? A molecular orbital approach, MAIN GR MET, 22(1), 1999, pp. 5-8
Citations number
23
Categorie Soggetti
Chemistry
Journal title
MAIN GROUP METAL CHEMISTRY
ISSN journal
07921241 → ACNP
Volume
22
Issue
1
Year of publication
1999
Pages
5 - 8
Database
ISI
SICI code
0792-1241(199901)22:1<5:WDTYIO>2.0.ZU;2-N
Abstract
Ab initio (RHF/3-21G*) calculations on Sn[(SePR2)(2)N](2) (R=H) suggest tha t tin coordinated by four selenium atoms does not have a strong preference either for square planar nor for pyramidal geometry. According to the semie mpirical PM3 calculations performed at the experimental geometries of Sn[(S ePPh2)(2)N](2) it is most likely that the isomer containing the planar Sn(I I) is stabilized by pi-pi interactions between the interlocked phenyl rings .