Geometry & MOs

Info

ID:	384733
PubChem CID:	134977586
Reduced:	BrOPH24C26 (2)
Stoich.:	ABCD24E26 (2)
Weight, g/mol:	311.14776
ΔH_f, kcal/mol:	66.17
Dipole, Da:	1.35
IP(EA), eV:	-8.27(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(E)-[di(propan-2-yl)hydrazinylidene]-sulfido-triethylphosphaniumylmethane;chloride

Drug info:

PubChemData

Smile

CCOC1=C(C=CC2=C1C=CC(=C2OCC)CP(C3=CC=CC=C3)(C4=CC=CC=C4)(C5=CC=CC=C5)Br)CP(C6=CC=CC=C6)(C7=CC=CC=C7)(C8=CC=CC=C8)Br

DOS

IR

Vibrations