Geometry & MOs

Info

ID:	142480
PubChem CID:	53042274
Reduced:	SN3O3C19H21 (1)
Stoich.:	AB3C3D19E21 (1)
Weight, g/mol:	314.083747
ΔH_f, kcal/mol:	-33.65
Dipole, Da:	5.96
IP(EA), eV:	-8.47(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylthiophen-3-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=NO1)C2=CC(=C(S2)C)NC(=O)CCC3=CC=C(C=C3)OC

DOS

IR

Vibrations