Geometry & MOs

Info

ID:	264393
PubChem CID:	103458908
Reduced:	OSC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	166.135765
ΔH_f, kcal/mol:	-28.16
Dipole, Da:	4.15
IP(EA), eV:	-9.18(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclobutyl-3-ethylpent-2-en-1-one

Drug info:

PubChemData

Smile

CCC(=CC(=O)C1=CC=C(S1)C)CC

DOS

IR

Vibrations