Geometry & MOs

Info

ID:	437394
PubChem CID:	135226203
Reduced:	F2O4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	286.101665
ΔH_f, kcal/mol:	-254.71
Dipole, Da:	3.98
IP(EA), eV:	-9.82(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R,5S)-2-(3,4-difluorophenyl)-5-(2-methoxyethyl)oxolane-3-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(CC(C)CCOC)C(=O)C1=CC(=C(C=C1)F)F

DOS

IR

Vibrations