Geometry & MOs

Info

ID:	322914
PubChem CID:	126671569
Reduced:	O2C7H14 (1)
Stoich.:	A2B7C14 (1)
Weight, g/mol:	144.11503
ΔH_f, kcal/mol:	-112.03
Dipole, Da:	3.5
IP(EA), eV:	-10.01(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-hydroxy-4,4-dimethylhexan-2-one

Drug info:

PubChemData

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CC[C@@H](C)[C@H](C(=O)C)O

DOS

IR

Vibrations