Geometry & MOs

Info

ID:	161783
PubChem CID:	57392652
Reduced:	FSO2N3H24C26 (1)
Stoich.:	ABC2D3E24F26 (1)
Weight, g/mol:	510.251858
ΔH_f, kcal/mol:	-27.02
Dipole, Da:	2.17
IP(EA), eV:	-9.25(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-phenylethyl)piperidin-3-yl]methyl 2-(3-benzyl-2,5-dioxopyrrolidin-1-yl)benzoate

Drug info:

PubChemData

Smile

C[C@](CCC1=CC(=C(C=C1)C2=NC3=C(S2)N=C(C=C3)C4(CC4)C5=CC=CC=C5)F)(C(=O)O)N

DOS

IR

Vibrations