Geometry & MOs

Info

ID:	7205
PubChem CID:	71521
Reduced:	INO3C21H26 (1)
Stoich.:	ABC3D21E26 (1)
Weight, g/mol:	467.09574
ΔH_f, kcal/mol:	-78.75
Dipole, Da:	12.1
IP(EA), eV:	-7.41(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpyrrolidin-1-ium-1-yl)ethyl 2-hydroxy-2,2-diphenylacetate;iodide

Drug info:

PubChemData

Smile

C[N+]1(CCCC1)CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.[I-]

DOS

IR

Vibrations