Geometry & MOs

Info

ID:	323494
PubChem CID:	126675031
Reduced:	N3O7C17H35 (1)
Stoich.:	A3B7C17D35 (1)
Weight, g/mol:	305.158685
ΔH_f, kcal/mol:	-345.78
Dipole, Da:	3.88
IP(EA), eV:	-8.91(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,6R)-4,6-diamino-3-[[(2S,3S)-3-amino-4-hydroxy-6-(hydroxymethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]cyclohexane-1,2-diol

Drug info:

PubChemData

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C[C@H](C1[C@H](C([C@@H]([C@H](O1)O[C@@H]2C(CC([C@H](C2O)O)NCC(C)C)N)N)O)O)O

DOS

IR

Vibrations