Geometry & MOs

Info

ID:	9955
PubChem CID:	95336
Reduced:	OH18C20 (1)
Stoich.:	AB18C20 (1)
Weight, g/mol:	274.135765
ΔH_f, kcal/mol:	31.6
Dipole, Da:	3.3
IP(EA), eV:	-9.37(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dibenzylidenecyclohexan-1-one

Drug info:

PubChemData

Smile

C1CC(=CC2=CC=CC=C2)C(=O)C(=CC3=CC=CC=C3)C1

DOS

IR

Vibrations