Geometry & MOs

Info

ID:	408069
PubChem CID:	135080824
Reduced:	NOC9H11 (1)
Stoich.:	ABC9D11 (1)
Weight, g/mol:	257.056923
ΔH_f, kcal/mol:	12.35
Dipole, Da:	2.42
IP(EA), eV:	-9.93(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R,5S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

C1C2CC(C1C=C2)[C@H](C#N)O

DOS

IR

Vibrations