Geometry & MOs

Info

ID:	144321
PubChem CID:	53350277
Reduced:	FeS2F6N6O6C23H30 (1)
Stoich.:	AB2C6D6E6F23G30 (1)
Weight, g/mol:	310.157382
ΔH_f, kcal/mol:	-465.44
Dipole, Da:	10.08
IP(EA), eV:	-8.84(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1-piperidin-1-ylpropan-2-yl 3-phenylpropanoate;chloride

Drug info:

PubChemData

Smile

CC#N.CN1CCN(CCN(CC1)C(C2=CC=CC=N2)C3=CC=CC=N3)C.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Fe+2]

DOS

IR

Vibrations