Geometry & MOs

Info

ID:	24897
PubChem CID:	614271
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-38.39
Dipole, Da:	2.15
IP(EA), eV:	-9.1(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[2-[hydroxy(phenyl)methyl]benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CN1C2=CC=CC=C2N=C1C(C3=CC=CC=C3)O

DOS

IR

Vibrations