Geometry & MOs

Info

ID:	381886
PubChem CID:	134972746
Reduced:	OSiN2C9H15 (2)
Stoich.:	ABC2D9E15 (2)
Weight, g/mol:	289.146664
ΔH_f, kcal/mol:	-135.48
Dipole, Da:	5.77
IP(EA), eV:	-8.55(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclohexanecarbonyl)phenyl]benzonitrile

Drug info:

PubChemData

Smile

CN(C1=C(N(C(=O)N=C1O[Si](C)(C)C)CC2=CC=CC=C2)N)[Si](C)(C)C

DOS

IR

Vibrations