Geometry & MOs

Info

ID:	72013
PubChem CID:	48415716
Reduced:	ON3C25H25 (1)
Stoich.:	AB3C25D25 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	41.63
Dipole, Da:	6.93
IP(EA), eV:	-9.05(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2-ethoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations