Geometry & MOs

Info

ID:	397342
PubChem CID:	135030075
Reduced:	OSiC19H22 (1)
Stoich.:	ABC19D22 (1)
Weight, g/mol:	452.256684
ΔH_f, kcal/mol:	6.78
Dipole, Da:	3.52
IP(EA), eV:	-8.99(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl-[2-(2-trimethylsilylethynyl)-4-tri(propan-2-yl)silyloxycyclohexa-1,4-dien-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CCC(=C(C1)C#C[Si](C)(C)C)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations