Geometry & MOs

Info

ID:	378925
PubChem CID:	134228441
Reduced:	ClO3N7C26H34 (1)
Stoich.:	AB3C7D26E34 (1)
Weight, g/mol:	408.179755
ΔH_f, kcal/mol:	-77.38
Dipole, Da:	0.68
IP(EA), eV:	-8.92(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-2-(3-tert-butylphenoxy)-8-methyl-5-oxo-1H-1,7-naphthyridine-6-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC(CCC1)N2C(=C(C(=N2)C3=CN(N=C3)CC4=CC(=CC=C4)Cl)C(=O)N)N

DOS

IR

Vibrations