Geometry & MOs

Info

ID:	2723
PubChem CID:	8381
Reduced:	PSN2O4C14H17 (1)
Stoich.:	ABC2D4E14F17 (1)
Weight, g/mol:	340.064665
ΔH_f, kcal/mol:	-183.56
Dipole, Da:	5.28
IP(EA), eV:	-8.8(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-diethoxyphosphinothioyloxy-2-phenylpyridazin-3-one

Drug info:

PubChemData

Smile

CCOP(=S)(OCC)OC1=NN(C(=O)C=C1)C2=CC=CC=C2

DOS

IR

Vibrations