Geometry & MOs

Info

ID:	380193
PubChem CID:	134970549
Reduced:	O3C27H28 (1)
Stoich.:	A3B27C28 (1)
Weight, g/mol:	397.167794
ΔH_f, kcal/mol:	-82.75
Dipole, Da:	5.08
IP(EA), eV:	-9.46(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-1-[(1S,2R)-1,2-diphenylcyclopropanecarbonyl]-5-(4-hydroxyphenyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)C(=O)OC(=O)C4(CC4C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations