Geometry & MOs

Info

ID:	412814
PubChem CID:	135085743
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	208.182715
ΔH_f, kcal/mol:	-54.38
Dipole, Da:	3.87
IP(EA), eV:	-9.57(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1-cyclohexyl-3-methylhept-2-en-1-one

Drug info:

PubChemData

Smile

CCC/C=N/C(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations