Geometry & MOs

Info

ID:

52674

PubChem CID:

12015663

Reduced:

NiN4O6H26C32 (1)

Stoich.:

AB4C6D26E32 (1)

Weight, g/mol:

564.200885

ΔHf, kcal/mol:

-64.99

Dipole, Da:

14.23

IP(EA), eV:

 -9.18(-2.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S,3R)-3-naphthalen-2-yl-5-oxo-5-(2-oxo-1,3-oxazolidin-3-yl)-2-[1-[2-(pyridine-2-carbonylamino)phenyl]ethylideneamino]pentanoic acid

Drug info:

PubChemData

Smile

CC(=N[C@@H]([C@H](CC(=O)N1CCOC1=O)C2=CC3=CC=CC=C3C=C2)C(=O)[O-])C4=CC=CC=C4[N-]C(=O)C5=CC=CC=N5.[Ni+2]

DOS

IR

Vibrations