Geometry & MOs

Info

ID:	28784
PubChem CID:	829602
Reduced:	ON5H11C12 (1)
Stoich.:	AB5C11D12 (1)
Weight, g/mol:	300.066555
ΔH_f, kcal/mol:	74.28
Dipole, Da:	7.67
IP(EA), eV:	-9.25(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC(=NNC(=O)C1=NC=CN=C1)C2=CN=CC=C2

DOS

IR

Vibrations