Geometry & MOs

Info

ID:	352447
PubChem CID:	127283535
Reduced:	NSO3C10H13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	269.054421
ΔH_f, kcal/mol:	-83.24
Dipole, Da:	4.73
IP(EA), eV:	-8.56(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(1-oxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(OC=C1)C(=O)N2CCS(=O)CC2

DOS

IR

Vibrations