Geometry & MOs

Info

ID:	34314
PubChem CID:	7890738
Reduced:	SN2O7C18H20 (1)
Stoich.:	AB2C7D18E20 (1)
Weight, g/mol:	375.121906
ΔH_f, kcal/mol:	-228.35
Dipole, Da:	11.15
IP(EA), eV:	-9.12(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(4-phenyldiazenylanilino)ethyl] 2-hydroxybenzoate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OCC(=O)NCC2=CC=CC=C2OC

DOS

IR

Vibrations