Geometry & MOs

Info

ID:	226911
PubChem CID:	87558904
Reduced:	CCuNO2H5 (1)
Stoich.:	ABCD2E5 (1)
Weight, g/mol:	834.179282
ΔH_f, kcal/mol:	-41.12
Dipole, Da:	4.94
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.778550
Charge, e:	0

Chem-info

IUPAC name:

dimethyl-bis[2-phenyl-7-(4-propan-2-ylphenyl)-3H-inden-3-id-1-yl]silane;zirconium(4+);dichloride

Drug info:

PubChemData

Smile

C(=O)O.N.[Cu]

DOS

IR

Vibrations