Geometry & MOs

Info

ID:	277995
PubChem CID:	103832541
Reduced:	BrOSN3H12C14 (1)
Stoich.:	ABCD3E12F14 (1)
Weight, g/mol:	334.9728
ΔH_f, kcal/mol:	81.65
Dipole, Da:	4.46
IP(EA), eV:	-9.32(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-[3-(4-bromothiophen-2-yl)-1,2,4-oxadiazol-5-yl]-phenylmethanamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C[C@@H](C2=NC(=NO2)C3=CC(=CS3)Br)N

DOS

IR

Vibrations