Geometry & MOs

Info

ID:	411295
PubChem CID:	135084108
Reduced:	SiF3C13H18 (1)
Stoich.:	AB3C13D18 (1)
Weight, g/mol:	182.167065
ΔH_f, kcal/mol:	-152.69
Dipole, Da:	3.97
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.751748
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-5-methylidenenonan-3-one

Drug info:

PubChemData

Smile

CCCCC1=C(C=C(C=C1)C(F)(F)F)[Si](C)C

DOS

IR

Vibrations