Geometry & MOs

Info

ID:	249435
PubChem CID:	103089409
Reduced:	NO2S2C8H15 (1)
Stoich.:	AB2C2D8E15 (1)
Weight, g/mol:	221.054421
ΔH_f, kcal/mol:	-98.02
Dipole, Da:	3.63
IP(EA), eV:	-8.75(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-2-(3-methylsulfanylpropyl)-1,3-thiazolidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CSCCCC1NC(CS1)C(=O)O

DOS

IR

Vibrations