Geometry & MOs

Info

ID:	338536
PubChem CID:	127259251
Reduced:	Cl2N2O5H6C9 (1)
Stoich.:	A2B2C5D6E9 (1)
Weight, g/mol:	260.995948
ΔH_f, kcal/mol:	-65.66
Dipole, Da:	5.22
IP(EA), eV:	-10.56(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-(2,6-dichlorophenyl)methylideneamino]oxymethyl acetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations