Geometry & MOs

Info

ID:	408407
PubChem CID:	135081173
Reduced:	LiS2Br3C6 (1)
Stoich.:	AB2C3D6 (1)
Weight, g/mol:	260.180771
ΔH_f, kcal/mol:	81.63
Dipole, Da:	8.55
IP(EA), eV:	-8.3(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-yl] butanoate

Drug info:

PubChemData

Smile

[Li+].[C-]1=C(SC2=C1SC(=C2Br)Br)Br

DOS

IR

Vibrations