Geometry & MOs

Info

ID:	433045
PubChem CID:	135173182
Reduced:	O4C17H30 (1)
Stoich.:	A4B17C30 (1)
Weight, g/mol:	297.108897
ΔH_f, kcal/mol:	-220.17
Dipole, Da:	2.42
IP(EA), eV:	-10.07(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC(CCC1CCC1)C(=O)OCC2COC(O2)(C)C

DOS

IR

Vibrations