Geometry & MOs

Info

ID:	68572
PubChem CID:	46508672
Reduced:	N3O5C27H27 (1)
Stoich.:	A3B5C27D27 (1)
Weight, g/mol:	396.097763
ΔH_f, kcal/mol:	-122.97
Dipole, Da:	5.95
IP(EA), eV:	-8.44(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,1-dioxothiolan-3-yl)-(thiophen-2-ylmethyl)amino]-N-(3-fluoro-4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)CC(=O)NC3=CC4=C(C=C3C(=O)C)OCO4

DOS

IR

Vibrations