Geometry & MOs

Info

ID:	338535
PubChem CID:	127259250
Reduced:	NSO3C8H15 (1)
Stoich.:	ABC3D8E15 (1)
Weight, g/mol:	291.965377
ΔH_f, kcal/mol:	-119.21
Dipole, Da:	4.73
IP(EA), eV:	-8.48(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-(2,6-dichloro-3-nitrophenyl)methylideneamino]oxyacetic acid

Drug info:

PubChemData

Smile

CC(=O)OC/C=N/[S@@](=O)C(C)(C)C

DOS

IR

Vibrations