Geometry & MOs

Info

ID:	410864
PubChem CID:	135083665
Reduced:	BF3C8H15 (1)
Stoich.:	AB3C8D15 (1)
Weight, g/mol:	214.138906
ΔH_f, kcal/mol:	-272.96
Dipole, Da:	0.94
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.896693
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-5-trimethylsilyloxyhex-5-en-3-one

Drug info:

PubChemData

Smile

[B-](C/C=C(\C)/CCCC)(F)(F)F

DOS

IR

Vibrations