Geometry & MOs

Info

ID:	406806
PubChem CID:	135078674
Reduced:	SiO4C19H22 (1)
Stoich.:	AB4C19D22 (1)
Weight, g/mol:	240.172545
ΔH_f, kcal/mol:	-124.38
Dipole, Da:	3.41
IP(EA), eV:	-8.62(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (E)-4,4-dimethyl-5-(2-methyloxiran-2-yl)pent-2-enoate

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=O)C2(C3=CC=CC=C3)O[Si](C)(C)C)OC

DOS

IR

Vibrations