Geometry & MOs

Info

ID:	287489
PubChem CID:	104244571
Reduced:	BrON2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	304.097855
ΔH_f, kcal/mol:	-15.31
Dipole, Da:	6.03
IP(EA), eV:	-8.4(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C2C(=CC(=NC2=C(C=C1)Br)C3CCCC3)N

DOS

IR

Vibrations