Geometry & MOs

Info

ID:	223376
PubChem CID:	85334935
Reduced:	OH9C10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	299.163377
ΔH_f, kcal/mol:	-28.47
Dipole, Da:	5.44
IP(EA), eV:	-9.08(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-oxocyclohexa-2,4-dien-1-ylidene)-2-piperidin-2-ylidenepiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=CC3=CC=CC=C3)C(=C2CC(=O)O)C

DOS

IR

Vibrations