Geometry & MOs

Info

ID:	4352
PubChem CID:	11271
Reduced:	OC7H14 (1)
Stoich.:	AB7C14 (1)
Weight, g/mol:	114.104465
ΔH_f, kcal/mol:	-70.22
Dipole, Da:	2.9
IP(EA), eV:	-9.61(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethylpentan-3-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations