Geometry & MOs

Info

ID:	403529
PubChem CID:	135060744
Reduced:	OSiC15H22 (1)
Stoich.:	ABC15D22 (1)
Weight, g/mol:	478.234681
ΔH_f, kcal/mol:	-45.65
Dipole, Da:	4.5
IP(EA), eV:	-9.43(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-3-(3-acetylphenyl)-2-[dimethyl(phenyl)silyl]-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CCCC/C(=C/C=O)/[Si](C)(C)C1=CC=CC=C1

DOS

IR

Vibrations