Geometry & MOs

Info

ID:	382175
PubChem CID:	134973149
Reduced:	NSiC19H21 (1)
Stoich.:	ABC19D21 (1)
Weight, g/mol:	366.259022
ΔH_f, kcal/mol:	86.25
Dipole, Da:	1.44
IP(EA), eV:	-8.97(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-[(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-2-ethenyl-5-hydroxycyclopentyl]oct-1-en-3-one

Drug info:

PubChemData

Smile

C[Si](C)(C)C/N=C/C1=CC=CC=C1C#CC2=CC=CC=C2

DOS

IR

Vibrations