Geometry & MOs

Info

ID:	149447
PubChem CID:	53789120
Reduced:	NSO2C10H11 (1)
Stoich.:	ABC2D10E11 (1)
Weight, g/mol:	253.023121
ΔH_f, kcal/mol:	-34.93
Dipole, Da:	1.82
IP(EA), eV:	-8.71(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-phenyl-2-sulfanylidene-1,3-thiazolidin-5-yl)acetic acid

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC1=CC=CC=C1SN

DOS

IR

Vibrations