Geometry & MOs

Info

ID:	72341
PubChem CID:	48416066
Reduced:	ON3C22H25 (1)
Stoich.:	AB3C22D25 (1)
Weight, g/mol:	368.148455
ΔH_f, kcal/mol:	4.88
Dipole, Da:	5.56
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3CCCC4=CC=CC=C34

DOS

IR

Vibrations