Geometry & MOs

Info

ID:	72125
PubChem CID:	48415837
Reduced:	O3N4C21H26 (1)
Stoich.:	A3B4C21D26 (1)
Weight, g/mol:	395.220892
ΔH_f, kcal/mol:	-67.88
Dipole, Da:	3.55
IP(EA), eV:	-8.98(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-4-butoxy-3-methoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N(C)CCCC1=NC2=CC=CC=C2N1)NC(=O)C3=CC=CO3

DOS

IR

Vibrations