Geometry & MOs

Info

ID:	405707
PubChem CID:	135075143
Reduced:	ClSSiN2O3C20H29 (1)
Stoich.:	ABCD2E3F20G29 (1)
Weight, g/mol:	332.096222
ΔH_f, kcal/mol:	-105.66
Dipole, Da:	3.59
IP(EA), eV:	-8.98(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-chloro-2-[4-(trifluoromethyl)phenyl]ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)O/N=C\1/CC(CC1Cl)CC(C#N)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations