Geometry & MOs

Info

ID:	265100
PubChem CID:	103510393
Reduced:	N3O4H11C12 (1)
Stoich.:	A3B4C11D12 (1)
Weight, g/mol:	263.070619
ΔH_f, kcal/mol:	-116.47
Dipole, Da:	8.79
IP(EA), eV:	-9.74(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-5-[(3-methylimidazole-4-carbonyl)amino]benzoic acid

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)NC2=CC(=C(C=C2)C(=O)O)O

DOS

IR

Vibrations