Geometry & MOs

Info

ID:	411803
PubChem CID:	135084648
Reduced:	PdCl4N4C35H66 (1)
Stoich.:	AB4C4D35E66 (1)
Weight, g/mol:	262.021914
ΔH_f, kcal/mol:	-88.66
Dipole, Da:	2.85
IP(EA), eV:	-7.67(-3.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-phenyl 2-(2-chlorophenyl)ethanethioate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCN1[CH-]N(C=C1)CN2[CH-]N(C=C2)CCCCCCCCCCCCCC.Cl[Pd](Cl)(Cl)Cl

DOS

IR

Vibrations