Geometry & MOs

Info

ID:	405605
PubChem CID:	135074622
Reduced:	Si2O3C26H40 (1)
Stoich.:	A2B3C26D40 (1)
Weight, g/mol:	352.059229
ΔH_f, kcal/mol:	-80.67
Dipole, Da:	0.47
IP(EA), eV:	-8.76(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (Z)-3-phenyl-3-(trifluoromethylsulfonyloxy)prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCC#CC#C/C=C\C(C#CC#CCO[Si](C)(C)C(C)(C)C)O

DOS

IR

Vibrations