Geometry & MOs

Info

ID:	300156
PubChem CID:	121147422
Reduced:	ClFSO2N3H9C14 (1)
Stoich.:	ABCD2E3F9G14 (1)
Weight, g/mol:	330.042276
ΔH_f, kcal/mol:	-27.15
Dipole, Da:	6.28
IP(EA), eV:	-9.04(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)thiophen-2-yl]-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2=C(SC=C2)NC(=O)C3=C(C=CC=C3Cl)F

DOS

IR

Vibrations