Geometry & MOs

Info

ID:	408740
PubChem CID:	135081508
Reduced:	AuClPC14H14 (2)
Stoich.:	ABCD14E14 (2)
Weight, g/mol:	940.19367
ΔH_f, kcal/mol:	103.71
Dipole, Da:	14.35
IP(EA), eV:	-8.86(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethylbut-1-yne;diphenylphosphanylmethyl(diphenyl)phosphane;gold(1+)

Drug info:

PubChemData

Smile

[CH2-][P+]([CH2-])(C1=CC=CC=C1)C2=CC=CC=C2.[CH2-]P([CH2-])(C1=CC=CC=C1)(C2=CC=CC=C2)Cl.Cl[Au].[Au+]

DOS

IR

Vibrations