Geometry & MOs

Info

ID:	132255
PubChem CID:	51330044
Reduced:	NO4H17C18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	391.192963
ΔH_f, kcal/mol:	-53.39
Dipole, Da:	6.38
IP(EA), eV:	-8.48(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(2,5-dimethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(=O)NC2=CC=CC(=C2)C#C)OC)OC

DOS

IR

Vibrations