Geometry & MOs

Info

ID:	264379
PubChem CID:	103458344
Reduced:	O2C15H22 (1)
Stoich.:	A2B15C22 (1)
Weight, g/mol:	198.16198
ΔH_f, kcal/mol:	-98.04
Dipole, Da:	4.98
IP(EA), eV:	-9.53(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-hydroxy-7-methylidenenonan-5-one

Drug info:

PubChemData

Smile

CCC(CC)C(C(=O)C1=CC(=C(C=C1)C)C)O

DOS

IR

Vibrations