Geometry & MOs

Info

ID:	227710
PubChem CID:	87562279
Reduced:	FN6C22H29 (1)
Stoich.:	AB6C22D29 (1)
Weight, g/mol:	437.034938
ΔH_f, kcal/mol:	24.48
Dipole, Da:	2.68
IP(EA), eV:	-8.22(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-5-quinolin-6-ylpyridin-3-yl)-2,1,3-benzoxadiazole-4-sulfonamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=CC=C(C=C2)NC3=NC=C4C=CN(C4=N3)CCCN)CCF

DOS

IR

Vibrations