Geometry & MOs

Info

ID:	288733
PubChem CID:	104324581
Reduced:	N2O3C12H12 (1)
Stoich.:	A2B3C12D12 (1)
Weight, g/mol:	264.97384
ΔH_f, kcal/mol:	-37.38
Dipole, Da:	6.03
IP(EA), eV:	-9.37(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromoethoxy)-1-benzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(O2)C#N)OCC(CN)O

DOS

IR

Vibrations