Geometry & MOs

Info

ID:	409713
PubChem CID:	135082498
Reduced:	BrNOPC26H39 (1)
Stoich.:	ABCDE26F39 (1)
Weight, g/mol:	707.899021
ΔH_f, kcal/mol:	-42.57
Dipole, Da:	7.07
IP(EA), eV:	-8.4(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

gold(1+);1,2,3,4,5-pentachlorobenzene-6-ide;triphenylphosphane

Drug info:

PubChemData

Smile

CCCCP(CCCC)(CCCC)(C1=CC=CC=C1C=NC2=CC=C(C=C2)OC)Br

DOS

IR

Vibrations