Geometry & MOs

Info

ID:	168150
PubChem CID:	74930028
Reduced:	N2O9C27H36 (1)
Stoich.:	A2B9C27D36 (1)
Weight, g/mol:	438.101417
ΔH_f, kcal/mol:	-389.63
Dipole, Da:	4.87
IP(EA), eV:	-9.7(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3,5-dichloropyridin-2-yl)methyl]-N-(1-phenylpropyl)benzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C1C(CCC(N1C(=O)C2CCCN2C(=O)OCC3=CC=CC=C3)C(=O)OC)C(=O)OC

DOS

IR

Vibrations