Geometry & MOs

Info

ID:	309901
PubChem CID:	126566219
Reduced:	NF3O3C11H18 (1)
Stoich.:	AB3C3D11E18 (1)
Weight, g/mol:	215.170771
ΔH_f, kcal/mol:	-324.37
Dipole, Da:	3.21
IP(EA), eV:	-10.34(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(3-methylsulfanylpropyl)-4-propylpyrrolidine

Drug info:

PubChemData

Smile

C1CC(CCC1COCCC(F)(F)F)NC(=O)O

DOS

IR

Vibrations