Geometry & MOs

Info

ID:	429998
PubChem CID:	135170055
Reduced:	N3C10H11 (2)
Stoich.:	A3B10C11 (2)
Weight, g/mol:	302.106671
ΔH_f, kcal/mol:	87.48
Dipole, Da:	5.68
IP(EA), eV:	-8.09(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-fluorophenyl)-6-morpholin-4-ylpyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CNC1=CC=C(C=C1)NC2=NC(=NC3=C2CC(CC3)N)C4=CC=NC=C4

DOS

IR

Vibrations