Geometry & MOs

Info

ID:	396542
PubChem CID:	135028706
Reduced:	AuClPSH14C20 (1)
Stoich.:	ABCDE14F20 (1)
Weight, g/mol:	320.253542
ΔH_f, kcal/mol:	100.51
Dipole, Da:	12.04
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.278435
Charge, e:	0

Chem-info

IUPAC name:

(4-tert-butylphenyl)methoxy-tri(propan-2-yl)silane

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[PH+]2C3=CC=CC4=C3C(=CC=C4)C5=CSC=C52.Cl[Au]

DOS

IR

Vibrations