Geometry & MOs

Info

ID:	427975
PubChem CID:	135165616
Reduced:	O5N9C18H29 (1)
Stoich.:	A5B9C18D29 (1)
Weight, g/mol:	389.165896
ΔH_f, kcal/mol:	-40.96
Dipole, Da:	6.69
IP(EA), eV:	-9.85(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-6-[(2R)-4-amino-6-azido-2,3-dihydroxycyclohexyl]oxy-5-azido-2-[(1R)-1-hydroxyethyl]oxane-3,4-diol

Drug info:

PubChemData

Smile

C[C@H]1C(C(OC(C1N=[N+]=[N-])OC2[C@@H](C(C(CC2N=[N+]=[N-])N=[N+]=[N-])OC(=O)C)O)C(C)C)C

DOS

IR

Vibrations