Geometry & MOs

Info

ID:	22474
PubChem CID:	597352
Reduced:	O2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	210.16198
ΔH_f, kcal/mol:	-123.87
Dipole, Da:	0.65
IP(EA), eV:	-9.75(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(4-methyl-3-oxopentyl)cyclohexan-1-one

Drug info:

PubChemData

Smile

CC(C)C(=O)CCC1(CCCCC1=O)C

DOS

IR

Vibrations