Geometry & MOs

Info

ID:	72120
PubChem CID:	48415832
Reduced:	ON4C23H26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	400.156912
ΔH_f, kcal/mol:	19.64
Dipole, Da:	4.18
IP(EA), eV:	-8.43(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCCC3=CNC4=CC=CC=C43

DOS

IR

Vibrations