Geometry & MOs

Info

ID:	288385
PubChem CID:	104316035
Reduced:	Br2O2F3N3H8C11 (1)
Stoich.:	A2B2C3D3E8F11 (1)
Weight, g/mol:	350.07422
ΔH_f, kcal/mol:	-147.94
Dipole, Da:	2.94
IP(EA), eV:	-9.87(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C2=C(C=C(C=N2)Br)Br)C(C(F)(F)F)O

DOS

IR

Vibrations