Geometry & MOs

Info

ID:	340548
PubChem CID:	127262559
Reduced:	N4O4H16C17 (1)
Stoich.:	A4B4C16D17 (1)
Weight, g/mol:	590.2158
ΔH_f, kcal/mol:	-37.08
Dipole, Da:	4.7
IP(EA), eV:	-8.95(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis[(1S)-2,2-dimethyl-1-naphthalen-1-ylpropyl]-4,5-dihydroimidazol-1-ium;iodide

Drug info:

PubChemData

Smile

C1C(=O)NC2=C(C=CC(=C2O1)[C@H](CN=[N+]=[N-])O)OCC3=CC=CC=C3

DOS

IR

Vibrations