Geometry & MOs

Info

ID:	318821
PubChem CID:	126653487
Reduced:	N2O6C19H34 (1)
Stoich.:	A2B6C19D34 (1)
Weight, g/mol:	504.236415
ΔH_f, kcal/mol:	-223.5
Dipole, Da:	6.43
IP(EA), eV:	-8.39(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S,5R)-2-[[3-aminopropyl-[2-[2-(4-chlorophenyl)ethylamino]ethyl]amino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

COCCOCCOCCN(CCOCCOCCOC)C1=CC=NC=C1

DOS

IR

Vibrations