Geometry & MOs

Info

ID:	374298
PubChem CID:	131326359
Reduced:	NCl2H5O5C8 (1)
Stoich.:	AB2C5D5E8 (1)
Weight, g/mol:	264.954478
ΔH_f, kcal/mol:	-118.37
Dipole, Da:	5.62
IP(EA), eV:	-10.57(-2.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dichloro-5-nitrophenyl)-2-hydroxyacetic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1[N+](=O)[O-])C(C(=O)O)O)Cl)Cl

DOS

IR

Vibrations