Geometry & MOs

Info

ID:	295367
PubChem CID:	117527462
Reduced:	N3C16H19 (1)
Stoich.:	A3B16C19 (1)
Weight, g/mol:	265.121512
ΔH_f, kcal/mol:	62.56
Dipole, Da:	5.38
IP(EA), eV:	-8.89(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methyl-2-pyridin-2-ylbenzimidazol-5-yl)propan-2-one

Drug info:

PubChemData

Smile

CC(C)(C#N)C1=CC2=C(C=C1)N(C(=N2)C3CCC3)C

DOS

IR

Vibrations