Geometry & MOs

Info

ID:	372922
PubChem CID:	131307079
Reduced:	O2N3C7H9 (1)
Stoich.:	A2B3C7D9 (1)
Weight, g/mol:	285.97532
ΔH_f, kcal/mol:	-57.0
Dipole, Da:	3.68
IP(EA), eV:	-10.31(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-bromo-6-fluoro-1H-benzimidazole-5-carboxylate

Drug info:

PubChemData

Smile

CN1C(=O)CC(C1=O)(CC#N)N

DOS

IR

Vibrations