Geometry & MOs

Info

ID:	81278
PubChem CID:	49854542
Reduced:	NO10C27H31 (1)
Stoich.:	AB10C27D31 (1)
Weight, g/mol:	142.059246
ΔH_f, kcal/mol:	-402.55
Dipole, Da:	9.2
IP(EA), eV:	-9.06(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

sodium;(hydroxyamino)-oxido-propan-2-yliminoazanium

Drug info:

PubChemData

Smile

C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(CCO)O)N)O

DOS

IR

Vibrations