Geometry & MOs

Info

ID:	259540
PubChem CID:	103167698
Reduced:	ClO2N3C12H16 (1)
Stoich.:	AB2C3D12E16 (1)
Weight, g/mol:	215.98983
ΔH_f, kcal/mol:	-48.16
Dipole, Da:	5.37
IP(EA), eV:	-9.5(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-(cyclobutylmethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)NC2=NC=CN=C2Cl

DOS

IR

Vibrations