Geometry & MOs

Info

ID:	44295
PubChem CID:	10502561
Reduced:	SiO6C22H38 (1)
Stoich.:	AB6C22D38 (1)
Weight, g/mol:	426.035845
ΔH_f, kcal/mol:	-340.47
Dipole, Da:	2.86
IP(EA), eV:	-9.18(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-chlorophenyl)-4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCCCCC(=O)C1=C(COC1=O)[C@H]([C@H]2COC(O2)(C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations