Geometry & MOs

Info

ID:	393013
PubChem CID:	135018915
Reduced:	ClO6H19C27 (1)
Stoich.:	AB6C19D27 (1)
Weight, g/mol:	315.186585
ΔH_f, kcal/mol:	-153.1
Dipole, Da:	6.26
IP(EA), eV:	-8.92(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (5S)-2-oxo-5-(2-trimethylsilyloxypropan-2-yl)pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)[C@@]12COC3=CC=CC=C3[C@@H]1C4=C(C5=CC=CC=C5C(=O)O4)O[C@@H]2C6=CC=CC=C6Cl

DOS

IR

Vibrations