Geometry & MOs

Info

ID:	409273
PubChem CID:	135082053
Reduced:	LiOS2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	253.9416
ΔH_f, kcal/mol:	96.16
Dipole, Da:	32.2
IP(EA), eV:	-5.47(-2.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;5-iodo-4H-1,3-benzodioxol-4-ide

Drug info:

PubChemData

Smile

[Li+].CC1=CC=C(C=C1)S[CH-][S@@](=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations