Geometry & MOs

Info

ID:	299546
PubChem CID:	117687467
Reduced:	SO6C12H20 (1)
Stoich.:	AB6C12D20 (1)
Weight, g/mol:	310.025957
ΔH_f, kcal/mol:	-278.28
Dipole, Da:	3.62
IP(EA), eV:	-8.88(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-nitrobenzoyl) (4S)-4-methyl-2-oxo-1,3-thiazolidine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)SCC(C)(C(=O)OC)C(=O)OC(=O)OC

DOS

IR

Vibrations