Geometry & MOs

Info

ID:	206253
PubChem CID:	80223400
Reduced:	ClON3C12H12 (1)
Stoich.:	ABC3D12E12 (1)
Weight, g/mol:	241.086957
ΔH_f, kcal/mol:	1.28
Dipole, Da:	2.42
IP(EA), eV:	-8.93(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloropyridin-2-yl)-3-(oxolan-2-yl)propan-1-ol

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Cl)C(CC2=CC(=NC=C2)N)O

DOS

IR

Vibrations