Geometry & MOs

Info

ID:	288089
PubChem CID:	104310724
Reduced:	BrON4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	322.04292
ΔH_f, kcal/mol:	43.48
Dipole, Da:	3.03
IP(EA), eV:	-9.23(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC(C)(C)C1=NC(=NO1)C2=C(C=CC=N2)Br

DOS

IR

Vibrations