Geometry & MOs

Info

ID:	300150
PubChem CID:	121147416
Reduced:	BrSO2N3H10C14 (1)
Stoich.:	ABC2D3E10F14 (1)
Weight, g/mol:	410.95384
ΔH_f, kcal/mol:	29.66
Dipole, Da:	3.8
IP(EA), eV:	-9.12(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations