Geometry & MOs

Info

ID:	12289
PubChem CID:	134200
Reduced:	PN6O7C10H15 (1)
Stoich.:	AB6C7D10E15 (1)
Weight, g/mol:	362.073984
ΔH_f, kcal/mol:	-265.1
Dipole, Da:	8.45
IP(EA), eV:	-9.8(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]oxyphosphonamidic acid

Drug info:

PubChemData

Smile

C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NOP(=O)(N)O

DOS

IR

Vibrations