Geometry & MOs

Info

ID:	54309
PubChem CID:	16974415
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	369.16079
ΔH_f, kcal/mol:	-36.62
Dipole, Da:	4.98
IP(EA), eV:	-8.71(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[2-(1-pentylbenzimidazol-2-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CCCC(=O)NCCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)OC

DOS

IR

Vibrations