Geometry & MOs

Info

ID:	374297
PubChem CID:	131326347
Reduced:	ON2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	264.954478
ΔH_f, kcal/mol:	-30.68
Dipole, Da:	4.27
IP(EA), eV:	-8.35(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dichloro-6-nitrophenyl)-2-hydroxyacetic acid

Drug info:

PubChemData

Smile

CC(C)CC(C1=CNC2=C1C(=CC=C2)O)N

DOS

IR

Vibrations