Geometry & MOs

Info

ID:	232464
PubChem CID:	87576240
Reduced:	BrN2S2O4C6H7 (1)
Stoich.:	AB2C2D4E6F7 (1)
Weight, g/mol:	172.107558
ΔH_f, kcal/mol:	-119.68
Dipole, Da:	2.82
IP(EA), eV:	-10.43(-2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;1,3-diethoxybenzene-6-ide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)S(=O)(=O)NBr)S(=O)(=O)N

DOS

IR

Vibrations