Geometry & MOs

Info

ID:	165737
PubChem CID:	74589428
Reduced:	SN3O3C15H27 (1)
Stoich.:	AB3C3D15E27 (1)
Weight, g/mol:	380.246378
ΔH_f, kcal/mol:	-133.08
Dipole, Da:	3.29
IP(EA), eV:	-9.19(0.14)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

1'-[(4-hydroxyphenyl)methyl]-1-pyrrolidin-1-ium-1-ylspiro[1,2-dihydroindene-3,4'-piperidin-1-ium]-2-ol

Drug info:

PubChemData

Smile

CC=C(C)C(=O)N1CCCC2C1CCN(C2)S(=O)(=O)N(C)C

DOS

IR

Vibrations