Geometry & MOs

Info

ID:	383981
PubChem CID:	134976111
Reduced:	LiS2C8H11 (1)
Stoich.:	AB2C8D11 (1)
Weight, g/mol:	278.164696
ΔH_f, kcal/mol:	16.27
Dipole, Da:	5.46
IP(EA), eV:	-7.3(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-(diethoxyphosphorylmethyl)-5,5-dimethylhexan-2-one

Drug info:

PubChemData

Smile

[Li+].[CH2-]/C=C/C=C1SCCCS1

DOS

IR

Vibrations