Geometry & MOs

Info

ID:	25544
PubChem CID:	626309
Reduced:	Cl2N2O2H8C13 (1)
Stoich.:	A2B2C2D8E13 (1)
Weight, g/mol:	294.047953
ΔH_f, kcal/mol:	52.92
Dipole, Da:	6.19
IP(EA), eV:	-9.6(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethoxy-(2-hydroxyphenyl)phosphinothioyl]phenol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C=NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl

DOS

IR

Vibrations