Geometry & MOs

Info

ID:	263181
PubChem CID:	103343658
Reduced:	O2C7H8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	210.050379
ΔH_f, kcal/mol:	-148.17
Dipole, Da:	3.68
IP(EA), eV:	-9.0(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyl-3-(2,2,2-trifluoroethyl)oxolan-2-one

Drug info:

PubChemData

Smile

CC(=O)C1(CCOC1=O)CC2=CC=C(C=C2)OC

DOS

IR

Vibrations