Geometry & MOs

Info

ID:	221571
PubChem CID:	85279990
Reduced:	O2C13H14 (1)
Stoich.:	A2B13C14 (1)
Weight, g/mol:	203.040485
ΔH_f, kcal/mol:	15.89
Dipole, Da:	3.2
IP(EA), eV:	-8.75(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-4-sulfanylidene-3-azabicyclo[3.1.0]hexan-2-one

Drug info:

PubChemData

Smile

CC1=CC2(C3=CC=CC=C3C1(OO2)C)C

DOS

IR

Vibrations