Geometry & MOs

Info

ID:	122959
PubChem CID:	50828586
Reduced:	FO2N3H18C19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	439.044268
ΔH_f, kcal/mol:	-35.01
Dipole, Da:	4.64
IP(EA), eV:	-9.7(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)thiophen-2-yl]sulfonyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C1=CC=C(C=C1)C2=NC(=NO2)C3=CC=C(C=C3)F

DOS

IR

Vibrations