Geometry & MOs

Info

ID:	150902
PubChem CID:	53790599
Reduced:	NC12H21 (1)
Stoich.:	AB12C21 (1)
Weight, g/mol:	178.09938
ΔH_f, kcal/mol:	-19.99
Dipole, Da:	1.65
IP(EA), eV:	-8.32(3.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6,6-trimethyl-4-oxocyclohex-2-en-1-ylidene)acetaldehyde

Drug info:

PubChemData

Smile

C1CC2CC3CCN(CC3)CC2C1

DOS

IR

Vibrations