Geometry & MOs

Info

ID:	168490
PubChem CID:	74975484
Reduced:	SF3O8C21H27 (1)
Stoich.:	AB3C8D21E27 (1)
Weight, g/mol:	587.273686
ΔH_f, kcal/mol:	-439.36
Dipole, Da:	6.76
IP(EA), eV:	-8.99(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3,4-dimethyl-2-[(4-methylphenyl)sulfonyloxymethyl]-5-oxo-3-[phenyl-di(propan-2-yl)silyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C=CC1CC=CC(=O)O1)(C(CC(C=CC=CC=CCO)O)OCS(=O)(=O)C(F)(F)F)O

DOS

IR

Vibrations