Geometry & MOs

Info

ID:	267519
PubChem CID:	103582528
Reduced:	BrClN2C10H10 (1)
Stoich.:	ABC2D10E10 (1)
Weight, g/mol:	300.00289
ΔH_f, kcal/mol:	58.26
Dipole, Da:	2.78
IP(EA), eV:	-8.76(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bicyclo[2.2.1]heptanyl)-5-bromo-3-chloropyridin-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations