Geometry & MOs

Info

ID:	389090
PubChem CID:	134991121
Reduced:	NSF3O3C18H20 (1)
Stoich.:	ABC3D3E18F20 (1)
Weight, g/mol:	238.159575
ΔH_f, kcal/mol:	-240.88
Dipole, Da:	13.54
IP(EA), eV:	-9.12(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[(2S)-2-naphthalen-2-ylpropylidene]pyrrolidin-1-ium

Drug info:

PubChemData

Smile

C[C@H](C=[N+]1CCCC1)C2=CC3=CC=CC=C3C=C2.C(F)(F)(F)S(=O)(=O)[O-]

DOS

IR

Vibrations