Geometry & MOs

Info

ID:

218935

PubChem CID:

85090202

Reduced:

P3N8C10O12H15 (1)

Stoich.:

A3B8C10D12E15 (1)

Weight, g/mol:

532.138125

ΔHf, kcal/mol:

-590.98

Dipole, Da:

6.13

IP(EA), eV:

 -9.54(-1.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-(aminomethyl)-3-[4-[4-[5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]-3-fluorophenyl]-1,3-oxazolidin-2-one;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(N=[N+]=[N-])O)O)O)N

DOS

IR

Vibrations