Geometry & MOs

Info

ID:	245852
PubChem CID:	103024429
Reduced:	O4C15H22 (1)
Stoich.:	A4B15C22 (1)
Weight, g/mol:	212.17763
ΔH_f, kcal/mol:	-165.07
Dipole, Da:	5.99
IP(EA), eV:	-9.12(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyl-4-methoxy-4-methylpentan-1-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations