Geometry & MOs

Info

ID:	409461
PubChem CID:	135082242
Reduced:	NAu2P3H35C38 (1)
Stoich.:	AB2C3D35E38 (1)
Weight, g/mol:	560.096833
ΔH_f, kcal/mol:	197.71
Dipole, Da:	5.82
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.752294
Charge, e:	0

Chem-info

IUPAC name:

diphenyl-(4-phenylphenyl)phosphane;ethyne;gold(1+)

Drug info:

PubChemData

Smile

[CH2-][P+]([CH2-])(C1=CC=CC=C1)C2=CC=CC=C2.C1=CC=C(C=C1)P(C2=CC=CC=C2)NP(C3=CC=CC=C3)C4=CC=CC=C4.[Au+].[Au+]

DOS

IR

Vibrations