Geometry & MOs

Info

ID:	287491
PubChem CID:	104245024
Reduced:	N2O3C13H14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	348.04734
ΔH_f, kcal/mol:	-29.34
Dipole, Da:	1.28
IP(EA), eV:	-9.61(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)CC2=NC(=NO2)C3=CC=CO3

DOS

IR

Vibrations