Geometry & MOs

Info

ID:	366108
PubChem CID:	127319469
Reduced:	FN2S2O3C16H17 (1)
Stoich.:	AB2C2D3E16F17 (1)
Weight, g/mol:	355.066048
ΔH_f, kcal/mol:	-136.64
Dipole, Da:	6.14
IP(EA), eV:	-9.56(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations