Geometry & MOs

Info

ID:	292290
PubChem CID:	114915861
Reduced:	FOSN3H10C13 (1)
Stoich.:	ABCD3E10F13 (1)
Weight, g/mol:	348.98845
ΔH_f, kcal/mol:	20.25
Dipole, Da:	7.38
IP(EA), eV:	-8.48(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CSC(=C1N)C2=NC(=NO2)C3=CC(=CC=C3)F

DOS

IR

Vibrations