Geometry & MOs

Info

ID:	206121
PubChem CID:	80208064
Reduced:	BrNO2C10H14 (1)
Stoich.:	ABC2D10E14 (1)
Weight, g/mol:	331.89829
ΔH_f, kcal/mol:	-64.28
Dipole, Da:	2.01
IP(EA), eV:	-9.92(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromofuran-2-yl)-(5-bromopyridin-3-yl)methanamine

Drug info:

PubChemData

Smile

CCCOCC(C1=CC(=CN=C1)Br)O

DOS

IR

Vibrations