Geometry & MOs

Info

ID:	396517
PubChem CID:	135028613
Reduced:	OC8H8 (2)
Stoich.:	AB8C8 (2)
Weight, g/mol:	316.149471
ΔH_f, kcal/mol:	-13.11
Dipole, Da:	4.96
IP(EA), eV:	-9.67(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[tert-butyl(dimethyl)silyl]oxy-1-phenylhex-3-yne-1,2-dione

Drug info:

PubChemData

Smile

C1CCC(CC1)C#CC(=O)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations