Geometry & MOs

Info

ID:	277993
PubChem CID:	103832516
Reduced:	O2N3C11H17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	334.9728
ΔH_f, kcal/mol:	-33.73
Dipole, Da:	5.59
IP(EA), eV:	-9.72(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C[C@@H](NC1)C2=NC(=NO2)CC3CCCO3

DOS

IR

Vibrations