Geometry & MOs

Info

ID:	337384
PubChem CID:	127257069
Reduced:	SO2N4C7H12 (1)
Stoich.:	AB2C4D7E12 (1)
Weight, g/mol:	241.040879
ΔH_f, kcal/mol:	-75.21
Dipole, Da:	3.46
IP(EA), eV:	-8.9(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,6-dioxocyclohexen-1-yl) 1,3-thiazolidine-3-carboxylate

Drug info:

PubChemData

Smile

CNC(=O)/N=C\1/N(CCS1)C(=O)NC

DOS

IR

Vibrations