Geometry & MOs

Info

ID:	20425
PubChem CID:	583875
Reduced:	OC16H22 (1)
Stoich.:	AB16C22 (1)
Weight, g/mol:	230.167065
ΔH_f, kcal/mol:	-57.06
Dipole, Da:	3.25
IP(EA), eV:	-9.38(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-1-(2,4-dimethylphenyl)propan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)CCC2CCCC2)C

DOS

IR

Vibrations