Geometry & MOs

Info

ID:	288299
PubChem CID:	104314845
Reduced:	Br2N2C13H20 (1)
Stoich.:	A2B2C13D20 (1)
Weight, g/mol:	359.92959
ΔH_f, kcal/mol:	1.16
Dipole, Da:	1.99
IP(EA), eV:	-8.06(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dibromopyridin-2-yl)-(furan-3-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCCCCC(C1=C(C=C(C=N1)Br)Br)NCC

DOS

IR

Vibrations