Geometry & MOs

Info

ID:	264363
PubChem CID:	103457683
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	220.182715
ΔH_f, kcal/mol:	-76.05
Dipole, Da:	3.31
IP(EA), eV:	-9.92(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylidene-1-(3-methylcyclohexyl)ethanone

Drug info:

PubChemData

Smile

C1CCC(CC1)C(C(=O)CC2=CC=NC=C2)O

DOS

IR

Vibrations