Geometry & MOs

Info

ID:	267492
PubChem CID:	103582376
Reduced:	BrClN2C10H14 (1)
Stoich.:	ABC2D10E14 (1)
Weight, g/mol:	302.01854
ΔH_f, kcal/mol:	0.5
Dipole, Da:	3.0
IP(EA), eV:	-8.66(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-cycloheptylpyridin-2-amine

Drug info:

PubChemData

Smile

CC(C)C(C)NC1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations