Geometry & MOs

Info

ID:	147547
PubChem CID:	53787203
Reduced:	SO3C44H90 (1)
Stoich.:	AB3C44D90 (1)
Weight, g/mol:	230.108899
ΔH_f, kcal/mol:	-312.98
Dipole, Da:	3.3
IP(EA), eV:	-8.81(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-methyl-3-oxobutan-2-yl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCCC(C)CCCC(C)CCCC(C)CCOCC(COSC)OCCC(C)CCCC(C)CCCC(C)CCCC(C)C

DOS

IR

Vibrations