Geometry & MOs

Info

ID:	385914
PubChem CID:	134980316
Reduced:	SiO7C19H32 (1)
Stoich.:	AB7C19D32 (1)
Weight, g/mol:	236.066029
ΔH_f, kcal/mol:	-384.94
Dipole, Da:	2.1
IP(EA), eV:	-9.21(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1S,2R,3S,4R)-3-(trifluoromethyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1CC=C(C[C@@]1(C(=O)OC)C(=O)OC(C)(C)C)O[Si](C)(C)C

DOS

IR

Vibrations