Geometry & MOs

Info

ID:	11716
PubChem CID:	119632
Reduced:	OC8H14 (1)
Stoich.:	AB8C14 (1)
Weight, g/mol:	126.104465
ΔH_f, kcal/mol:	-71.68
Dipole, Da:	3.32
IP(EA), eV:	-9.68(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,4-trimethylcyclopentan-1-one

Drug info:

PubChemData

Smile

CC1CC(=O)C(C1)(C)C

DOS

IR

Vibrations