Geometry & MOs

Info

ID:	216404
PubChem CID:	85086182
Reduced:	OF3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	265.116152
ΔH_f, kcal/mol:	-228.21
Dipole, Da:	5.4
IP(EA), eV:	-11.0(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,4-dihydroxypyrrolidin-2-yl)methoxy]oxane-3,4,5-triol

Drug info:

PubChemData

Smile

CCCCCCCCCCC=CC(=O)C(F)(F)F

DOS

IR

Vibrations