Geometry & MOs

Info

ID:	23313
PubChem CID:	603052
Reduced:	NOH9C12 (1)
Stoich.:	ABC9D12 (1)
Weight, g/mol:	183.068414
ΔH_f, kcal/mol:	46.34
Dipole, Da:	2.99
IP(EA), eV:	-9.37(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyliminocyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N=C2C=CC(=O)C=C2

DOS

IR

Vibrations