Geometry & MOs

Info

ID:	72236
PubChem CID:	48415955
Reduced:	ON6C20H22 (1)
Stoich.:	AB6C20D22 (1)
Weight, g/mol:	330.205576
ΔH_f, kcal/mol:	69.82
Dipole, Da:	3.43
IP(EA), eV:	-9.02(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-[3-(1H-benzimidazol-2-yl)propyl]-N,3-dimethylbutanamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3)N=N1

DOS

IR

Vibrations