Geometry & MOs

Info

ID:	288319
PubChem CID:	104314944
Reduced:	Br2N4C13H14 (1)
Stoich.:	A2B4C13D14 (1)
Weight, g/mol:	461.87649
ΔH_f, kcal/mol:	65.53
Dipole, Da:	3.7
IP(EA), eV:	-8.68(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromophenyl)-1-(3,5-dibromopyridin-2-yl)-N-ethylethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations