Geometry & MOs

Info

ID:	372356
PubChem CID:	131296551
Reduced:	BrON3H6C9 (1)
Stoich.:	ABC3D6E9 (1)
Weight, g/mol:	250.95819
ΔH_f, kcal/mol:	34.56
Dipole, Da:	7.91
IP(EA), eV:	-8.69(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-2,3-dihydro-1-benzofuran-5-carbonyl cyanide

Drug info:

PubChemData

Smile

CN1C=C(N2C1=CC(=CC2=O)C#N)Br

DOS

IR

Vibrations