Geometry & MOs

Info

ID:	161815
PubChem CID:	57392760
Reduced:	F2S2N5O5H17C25 (1)
Stoich.:	A2B2C5D5E17F25 (1)
Weight, g/mol:	437.118712
ΔH_f, kcal/mol:	-170.05
Dipole, Da:	13.78
IP(EA), eV:	-8.88(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,6-difluorophenyl)methyl]-N-(4-methoxyphenyl)-4,6-dioxo-5H-1,5-naphthyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)CN2C=C(C(=O)C3=C2C=CC(=O)N3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CS5)F

DOS

IR

Vibrations