Geometry & MOs

Info

ID:	295368
PubChem CID:	117527468
Reduced:	ON3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	237.126598
ΔH_f, kcal/mol:	33.41
Dipole, Da:	4.89
IP(EA), eV:	-8.83(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cyclopropyl-1-methylbenzimidazol-5-yl)cyclopropane-1-carbonitrile

Drug info:

PubChemData

Smile

CC(=O)CC1=CC2=C(C=C1)N(C(=N2)C3=CC=CC=N3)C

DOS

IR

Vibrations