Geometry & MOs

Info

ID:	18222
PubChem CID:	538954
Reduced:	OC12H22 (1)
Stoich.:	AB12C22 (1)
Weight, g/mol:	182.167065
ΔH_f, kcal/mol:	-80.15
Dipole, Da:	3.06
IP(EA), eV:	-9.05(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,8-trimethylnon-7-en-2-one

Drug info:

PubChemData

Smile

CC(=CCCC(C)(C)CC(=O)C)C

DOS

IR

Vibrations