Geometry & MOs

Info

ID:	288256
PubChem CID:	104314410
Reduced:	Br2Cl2N2H10C13 (1)
Stoich.:	A2B2C2D10E13 (1)
Weight, g/mol:	439.80161
ΔH_f, kcal/mol:	39.73
Dipole, Da:	0.97
IP(EA), eV:	-9.56(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromothiophen-2-yl)-1-(3,5-dibromopyridin-2-yl)ethanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CC(C2=C(C=C(C=N2)Br)Br)N)Cl

DOS

IR

Vibrations