Geometry & MOs

Info

ID:	81302
PubChem CID:	49854577
Reduced:	N2O3C28H30 (1)
Stoich.:	A2B3C28D30 (1)
Weight, g/mol:	385.19026
ΔH_f, kcal/mol:	-74.43
Dipole, Da:	7.73
IP(EA), eV:	-8.71(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminophenyl)-4-[(1-propan-2-ylbenzimidazol-2-yl)amino]benzamide

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)NCCC(=O)N2CCC3=C(C=CC=C32)CC4=CC=C(C=C4)C(=O)O

DOS

IR

Vibrations