Geometry & MOs

Info

ID:	71987
PubChem CID:	48415689
Reduced:	O3N4C19H20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	325.215413
ΔH_f, kcal/mol:	8.46
Dipole, Da:	5.02
IP(EA), eV:	-9.14(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2-(2-bicyclo[2.2.1]heptanyl)-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations