Geometry & MOs

Info

ID:	51095
PubChem CID:	12013718
Reduced:	SC14H24 (1)
Stoich.:	AB14C24 (1)
Weight, g/mol:	427.145344
ΔH_f, kcal/mol:	13.75
Dipole, Da:	1.85
IP(EA), eV:	-8.29(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-oxo-2-phenoxathiin-2-ylethyl) 1-hydroxy-2,2,5,5-tetramethylpyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1(C(C1(C#CC(C)(C)C)SC)(C)C)C

DOS

IR

Vibrations