Geometry & MOs

Info

ID:	408609
PubChem CID:	135081376
Reduced:	NOC17H17 (1)
Stoich.:	ABC17D17 (1)
Weight, g/mol:	670.136983
ΔH_f, kcal/mol:	17.22
Dipole, Da:	3.35
IP(EA), eV:	-8.69(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethylpropylsulfonylbenzene;gold(1+);triphenylphosphane

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)N=CCC(=O)C2=CC=CC=C2

DOS

IR

Vibrations