Geometry & MOs

Info

ID:	71929
PubChem CID:	48415628
Reduced:	O2N5C22H23 (1)
Stoich.:	A2B5C22D23 (1)
Weight, g/mol:	418.096331
ΔH_f, kcal/mol:	39.37
Dipole, Da:	3.62
IP(EA), eV:	-8.96(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[3-(1H-benzimidazol-2-yl)propyl-methylamino]-2-oxoethyl]-2,4-dichlorobenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCC3=NC(=NO3)C4=CC=CC=C4

DOS

IR

Vibrations