Geometry & MOs

Info

ID:	402850
PubChem CID:	135057533
Reduced:	BClC3O3H6 (1)
Stoich.:	ABC3D3E6 (1)
Weight, g/mol:	387.967378
ΔH_f, kcal/mol:	-195.45
Dipole, Da:	2.37
IP(EA), eV:	-10.46(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

zinc;2-nitro-3H-1-benzofuran-3-ide

Drug info:

PubChemData

Smile

B(/C=C(/CO)\Cl)(O)O

DOS

IR

Vibrations