Geometry & MOs

Info

ID:	230425
PubChem CID:	87570871
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	309.017078
ΔH_f, kcal/mol:	-29.73
Dipole, Da:	0.96
IP(EA), eV:	-8.8(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,4S,5R)-2-[2-(dichloroamino)phenoxy]-5-(hydroxymethyl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

CCCCC/C=C/COC1=CC=CC(=C1)CN

DOS

IR

Vibrations