Geometry & MOs

Info

ID:	18665
PubChem CID:	545662
Reduced:	OC4H8 (2)
Stoich.:	AB4C8 (2)
Weight, g/mol:	144.11503
ΔH_f, kcal/mol:	-121.55
Dipole, Da:	4.58
IP(EA), eV:	-10.01(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-2,2-dimethylhexan-3-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations