Geometry & MOs

Info

ID:	265656
PubChem CID:	103537395
Reduced:	BrON2C10H13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	230.062219
ΔH_f, kcal/mol:	-11.74
Dipole, Da:	5.21
IP(EA), eV:	-9.13(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-fluoro-2-(3-methoxypyrrolidin-1-yl)pyridine

Drug info:

PubChemData

Smile

COC1CCN(C1)C2=C(C=NC=C2)Br

DOS

IR

Vibrations