Geometry & MOs

Info

ID:	170854
PubChem CID:	75286464
Reduced:	ON2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	388.151096
ΔH_f, kcal/mol:	32.04
Dipole, Da:	3.32
IP(EA), eV:	-9.0(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-(2,4-dimethylphenyl)pyrazolidin-3-yl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=NOC(=N2)C3CC(NN3)C4=CC=C(C=C4)C(C)C

DOS

IR

Vibrations