Geometry & MOs

Info

ID:	72086
PubChem CID:	48415797
Reduced:	ClO2N3H20C21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	375.194677
ΔH_f, kcal/mol:	-12.56
Dipole, Da:	6.13
IP(EA), eV:	-8.65(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2-(6,7-dimethyl-1-benzofuran-3-yl)-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C=CC=C2Cl)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations