Geometry & MOs

Info

ID:	319021
PubChem CID:	126654171
Reduced:	O2N7C36H45 (1)
Stoich.:	A2B7C36D45 (1)
Weight, g/mol:	233.060055
ΔH_f, kcal/mol:	10.02
Dipole, Da:	2.15
IP(EA), eV:	-8.41(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-(6-fluoropyridin-3-yl)pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C[C@H]1CN(C(CN1C)C)CC2=CC=C(C=C2)C3=CC=C(C=C3)CO[C@H]4CCC[C@@H]4NC(=O)C5=C(N=CC(=C5)C6=CN(N=C6)C)N

DOS

IR

Vibrations