Geometry & MOs

Info

ID:	71982
PubChem CID:	48415683
Reduced:	N3O3H19C21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	368.148455
ΔH_f, kcal/mol:	-38.61
Dipole, Da:	4.84
IP(EA), eV:	-8.9(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-4-methoxy-N-methyl-3-nitrobenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC4=CC=CC=C4OC3=O

DOS

IR

Vibrations