Geometry & MOs

Info

ID:	17078
PubChem CID:	483319
Reduced:	O2F3N3H12C17 (1)
Stoich.:	A2B3C3D12E17 (1)
Weight, g/mol:	347.088161
ΔH_f, kcal/mol:	-157.06
Dipole, Da:	4.53
IP(EA), eV:	-9.98(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(trifluoromethoxy)phenyl]methyl]-1,6-naphthyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CNC(=O)C2=NC3=C(C=C2)C=NC=C3)OC(F)(F)F

DOS

IR

Vibrations