Geometry & MOs

Info

ID:	154954
PubChem CID:	56314511
Reduced:	FSN3O3C19H30 (1)
Stoich.:	ABC3D3E19F30 (1)
Weight, g/mol:	445.147156
ΔH_f, kcal/mol:	-172.93
Dipole, Da:	9.03
IP(EA), eV:	-8.84(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-fluoro-2-(1-methylimidazol-2-yl)sulfanylphenyl]-3-(2,3,4-trimethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCCCN1CCCCC1CNC(=O)[C@H](C)NS(=O)(=O)C2=CC=CC=C2F

DOS

IR

Vibrations