Geometry & MOs

Info

ID:	29202
PubChem CID:	832302
Reduced:	N2O5H14C16 (1)
Stoich.:	A2B5C14D16 (1)
Weight, g/mol:	330.083827
ΔH_f, kcal/mol:	-125.63
Dipole, Da:	5.48
IP(EA), eV:	-9.36(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(N2)C(=CC(=O)O3)C

DOS

IR

Vibrations