Geometry & MOs

Info

ID:	196855
PubChem CID:	78888369
Reduced:	O4C13H22 (1)
Stoich.:	A4B13C22 (1)
Weight, g/mol:	246.98441
ΔH_f, kcal/mol:	-195.69
Dipole, Da:	4.24
IP(EA), eV:	-9.76(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(2-hydroxyethyl)-3-methylfuran-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)OCC(=O)OCC2CCCCO2

DOS

IR

Vibrations