Geometry & MOs

Info

ID:	72110
PubChem CID:	48415822
Reduced:	N3O3C22H27 (1)
Stoich.:	A3B3C22D27 (1)
Weight, g/mol:	361.165108
ΔH_f, kcal/mol:	-67.61
Dipole, Da:	8.01
IP(EA), eV:	-8.43(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-4-(tetrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations