Geometry & MOs

Info

ID:	383980
PubChem CID:	134976110
Reduced:	LiPO3C9H18 (1)
Stoich.:	ABC3D9E18 (1)
Weight, g/mol:	178.046221
ΔH_f, kcal/mol:	-209.57
Dipole, Da:	7.09
IP(EA), eV:	-7.3(1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;2-[(E)-but-2-enylidene]-1,3-dithiane

Drug info:

PubChemData

Smile

[Li+].CCOP(=O)([CH-]C=C(C)C)OCC

DOS

IR

Vibrations