Geometry & MOs

Info

ID:

161868

PubChem CID:

57392893

Reduced:

SF2O5N7C32H33 (1)

Stoich.:

AB2C5D7E32F33 (1)

Weight, g/mol:

571.15772

ΔHf, kcal/mol:

-187.83

Dipole, Da:

10.73

IP(EA), eV:

 -8.63(-1.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-benzyl-N-[(4-fluorophenyl)methyl]-4-hydroxy-1-[(4-methylsulfonylphenyl)methyl]-2-oxo-1,5-naphthyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)OC2=CC=C(C=C2)NS(=O)(=O)C)CN3CCC(CC3)N(C4=CC(=CC=C4)F)C(=O)NC5=CC(=C(N=C5)C(=O)N)F

DOS

IR

Vibrations