Geometry & MOs

Info

ID:	28193
PubChem CID:	826158
Reduced:	O2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	302.108899
ΔH_f, kcal/mol:	-95.47
Dipole, Da:	0.98
IP(EA), eV:	-8.6(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-5-ethyl-5-[2-(2-methylanilino)-1,3-thiazol-4-yl]oxolan-2-one

Drug info:

PubChemData

Smile

C[C@H]1CCC[C@@H](C1(C2=CC=C(C=C2)OC)O)C

DOS

IR

Vibrations