Geometry & MOs

Info

ID:	246107
PubChem CID:	103044765
Reduced:	ClON2H9C12 (1)
Stoich.:	ABC2D9E12 (1)
Weight, g/mol:	281.062283
ΔH_f, kcal/mol:	34.72
Dipole, Da:	2.66
IP(EA), eV:	-9.17(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-quinolin-5-yloxypyridine-2-carbothioamide

Drug info:

PubChemData

Smile

C1=CC2=C(C=CC=N2)C(=C1)OCC(C#N)Cl

DOS

IR

Vibrations