Geometry & MOs

Info

ID:	308325
PubChem CID:	125326169
Reduced:	O2N3C5H9 (2)
Stoich.:	A2B3C5D9 (2)
Weight, g/mol:	286.138953
ΔH_f, kcal/mol:	-37.58
Dipole, Da:	2.69
IP(EA), eV:	-9.67(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R,5R,6R)-5,6-bis(azidomethyl)-2,3-dimethoxy-2,3-dimethyl-1,4-dioxane

Drug info:

PubChemData

Smile

C[C@]1([C@](O[C@@H]([C@H](O1)CN=[N+]=[N-])CN=[N+]=[N-])(C)OC)OC

DOS

IR

Vibrations