Geometry & MOs

Info

ID:	250571
PubChem CID:	103097591
Reduced:	BrO2N3H10C13 (1)
Stoich.:	AB2C3D10E13 (1)
Weight, g/mol:	277.066283
ΔH_f, kcal/mol:	8.17
Dipole, Da:	3.08
IP(EA), eV:	-8.76(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-difluorophenyl)-7-methylimidazo[1,2-a]imidazole-6-carboxylic acid

Drug info:

PubChemData

Smile

CN1C(=CN2C1=NC(=C2)C3=CC=CC=C3Br)C(=O)O

DOS

IR

Vibrations