Geometry & MOs

Info

ID:	69360
PubChem CID:	46530839
Reduced:	SN3O3C23H31 (1)
Stoich.:	AB3C3D23E31 (1)
Weight, g/mol:	376.099397
ΔH_f, kcal/mol:	-91.58
Dipole, Da:	2.94
IP(EA), eV:	-9.07(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-N-quinolin-8-ylbenzamide

Drug info:

PubChemData

Smile

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2CN3CCCC3

DOS

IR

Vibrations