Geometry & MOs

Info

ID:	412982
PubChem CID:	135085924
Reduced:	BN3C9H16 (1)
Stoich.:	AB3C9D16 (1)
Weight, g/mol:	269.83502
ΔH_f, kcal/mol:	-22.14
Dipole, Da:	6.29
IP(EA), eV:	-8.49(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dibromofuran-3-carboxylic acid

Drug info:

PubChemData

Smile

B1(N(C2CCCCC2N1C)C)C#N

DOS

IR

Vibrations