Geometry & MOs

Info

ID:	288086
PubChem CID:	104310688
Reduced:	BrON4H13C15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	335.96804
ΔH_f, kcal/mol:	70.96
Dipole, Da:	3.52
IP(EA), eV:	-8.56(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(3-bromopyridin-2-yl)-1,2,4-oxadiazol-5-yl]-5-methylthiophen-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)C2=NC(=NO2)C3=C(C=CC=N3)Br)N

DOS

IR

Vibrations