Geometry & MOs

Info

ID:	322245
PubChem CID:	126669522
Reduced:	F3N3O5H24C25 (1)
Stoich.:	A3B3C5D24E25 (1)
Weight, g/mol:	272.116092
ΔH_f, kcal/mol:	-298.69
Dipole, Da:	7.14
IP(EA), eV:	-9.06(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-[2-(aminomethyl)phenoxy]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CNC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2CNC(=O)NC3=C(C=CC(=C3)OC(F)(F)F)OC

DOS

IR

Vibrations