Geometry & MOs

Info

ID:	308324
PubChem CID:	125326161
Reduced:	ClNO3H14C16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	286.138953
ΔH_f, kcal/mol:	-85.03
Dipole, Da:	3.6
IP(EA), eV:	-9.73(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2C(=N[C@@H]1C(=O)O)C[C@H](CC2=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations