Geometry & MOs

Info

ID:	223688
PubChem CID:	85335422
Reduced:	N2O4C11H21 (2)
Stoich.:	A2B4C11D21 (2)
Weight, g/mol:	490.053621
ΔH_f, kcal/mol:	-409.32
Dipole, Da:	13.92
IP(EA), eV:	-9.46(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

disodium;[2-chloro-5-(1,3'-dimethoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)phenyl] phosphate

Drug info:

PubChemData

Smile

CN(CC(=O)O)C(=O)CCCCCCCCC(=O)N(C)CC(=O)O.C(CCN)CC(C(=O)O)N

DOS

IR

Vibrations