Geometry & MOs

Info

ID:	443209
PubChem CID:	135258111
Reduced:	PN3O10C13H22 (1)
Stoich.:	AB3C10D13E22 (1)
Weight, g/mol:	237.086189
ΔH_f, kcal/mol:	-502.38
Dipole, Da:	11.89
IP(EA), eV:	-10.21(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(6-aminopurin-9-yl)-methoxymethyl]oxiran-2-ol

Drug info:

PubChemData

Smile

C(CC(=O)NCCOP(=O)(N[C@@H](CCC(=O)O)C(=O)O)O)[C@H](C=N)C(=O)O

DOS

IR

Vibrations