Geometry & MOs

Info

ID:	267499
PubChem CID:	103582398
Reduced:	BrClN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	324.00289
ΔH_f, kcal/mol:	40.71
Dipole, Da:	3.54
IP(EA), eV:	-8.68(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(3-phenylpropyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations