Geometry & MOs

Info

ID:	313593
PubChem CID:	126616139
Reduced:	ClOSN3H26C30 (1)
Stoich.:	ABCD3E26F30 (1)
Weight, g/mol:	658.157218
ΔH_f, kcal/mol:	83.89
Dipole, Da:	2.66
IP(EA), eV:	-8.89(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[6-[bis(4-chlorophenyl)methyl]-2-cyclopropylbenzimidazol-1-yl]piperidin-1-yl]sulfonylbenzamide

Drug info:

PubChemData

Smile

C1CC1C2=NC3=C(N2C4CCC5=CC=CC=C5C4)C=C(C=C3)C(C6=CC=C(C=C6)Cl)(C7=NC=CS7)O

DOS

IR

Vibrations