Geometry & MOs

Info

ID:	389925
PubChem CID:	134996075
Reduced:	CrO2C6H10 (1)
Stoich.:	AB2C6D10 (1)
Weight, g/mol:	243.071842
ΔH_f, kcal/mol:	6.26
Dipole, Da:	2.05
IP(EA), eV:	-7.36(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(2S,3R,4R,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]methyl]-2,2,2-trifluoroacetamide

Drug info:

PubChemData

Smile

C/C=C(/C(=[Cr])OC)\OC

DOS

IR

Vibrations