Geometry & MOs

Info

ID:	71965
PubChem CID:	48415665
Reduced:	ON6C20H20 (1)
Stoich.:	AB6C20D20 (1)
Weight, g/mol:	414.172562
ΔH_f, kcal/mol:	91.17
Dipole, Da:	6.15
IP(EA), eV:	-9.06(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-2-(2-methyl-N-methylsulfonylanilino)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations