Geometry & MOs

Info

ID:	148000
PubChem CID:	53787662
Reduced:	NOSCl2H7C13 (1)
Stoich.:	ABCD2E7F13 (1)
Weight, g/mol:	333.076786
ΔH_f, kcal/mol:	9.24
Dipole, Da:	6.68
IP(EA), eV:	-8.52(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-[1-(4-chlorophenyl)ethylideneamino]oxyphenyl]-2-hydroxyacetate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=C3C=C(C=C(C3=O)Cl)Cl)S2

DOS

IR

Vibrations