Geometry & MOs

Info

ID:	266935
PubChem CID:	103580126
Reduced:	BrClN3C11H15 (1)
Stoich.:	ABC3D11E15 (1)
Weight, g/mol:	289.98215
ΔH_f, kcal/mol:	45.72
Dipole, Da:	3.32
IP(EA), eV:	-8.71(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(oxolan-3-ylmethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CN(CCNC1=C(C=C(C=N1)Br)Cl)C2CC2

DOS

IR

Vibrations