Geometry & MOs

Info

ID:	383311
PubChem CID:	134974954
Reduced:	ON3H25C30 (1)
Stoich.:	AB3C25D30 (1)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	73.79
Dipole, Da:	3.16
IP(EA), eV:	-8.13(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-(3-methyl-2H-benzimidazol-1-yl)cyclohexyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)N5CN(C6=CC=CC=C65)C

DOS

IR

Vibrations