Geometry & MOs

Info

ID:	380890
PubChem CID:	134971478
Reduced:	SO4C16H24 (1)
Stoich.:	AB4C16D24 (1)
Weight, g/mol:	262.123189
ΔH_f, kcal/mol:	-173.44
Dipole, Da:	3.56
IP(EA), eV:	-8.53(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-phenyl-2-(2-phenylethyl)-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

CCOC(=O)CCCC[C@H](C[S@@](=O)C1=CC=C(C=C1)C)O

DOS

IR

Vibrations