Geometry & MOs

Info

ID:	271407
PubChem CID:	103675104
Reduced:	BrNO2C8H12 (1)
Stoich.:	ABC2D8E12 (1)
Weight, g/mol:	259.05718
ΔH_f, kcal/mol:	-56.6
Dipole, Da:	3.62
IP(EA), eV:	-9.34(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromofuran-2-yl)methyl]hexan-1-amine

Drug info:

PubChemData

Smile

C1=COC(=C1Br)CNCCCO

DOS

IR

Vibrations