Geometry & MOs

Info

ID:	43322
PubChem CID:	10321124
Reduced:	OF3N4C24H25 (1)
Stoich.:	AB3C4D24E25 (1)
Weight, g/mol:	442.178024
ΔH_f, kcal/mol:	-133.03
Dipole, Da:	8.95
IP(EA), eV:	-8.73(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-2-ethoxy-2-oxo-1-phenylethyl] (1S,2S,3R)-5-oxo-2,3-diphenylcyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(N=C(N1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F)C(=O)N4CCN(CC4)C

DOS

IR

Vibrations