Geometry & MOs

Info

ID:	279109
PubChem CID:	103841237
Reduced:	NSBr2O3H9C13 (1)
Stoich.:	ABC2D3E9F13 (1)
Weight, g/mol:	274.07537
ΔH_f, kcal/mol:	-44.52
Dipole, Da:	2.41
IP(EA), eV:	-9.52(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-(2-fluoropyridine-4-carbonyl)anilino)acetic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(CC(=O)O)C(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations