Geometry & MOs

Info

ID:	389747
PubChem CID:	134994980
Reduced:	IS2C9H11 (1)
Stoich.:	AB2C9D11 (1)
Weight, g/mol:	203.098
ΔH_f, kcal/mol:	51.63
Dipole, Da:	2.1
IP(EA), eV:	-8.67(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-propyl (3R,4R)-2,3-dimethyl-1,2-oxazolidine-4-carbothioate

Drug info:

PubChemData

Smile

CSC1=C(C(C=CC=C1)I)SC

DOS

IR

Vibrations