Geometry & MOs

Info

ID:	16905
PubChem CID:	479233
Reduced:	O3N5C11H15 (1)
Stoich.:	A3B5C11D15 (1)
Weight, g/mol:	265.117489
ΔH_f, kcal/mol:	-51.86
Dipole, Da:	14.44
IP(EA), eV:	-8.98(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-9-[[(1S,2R)-2-[(1S)-1,2-dihydroxyethyl]cyclopropyl]methyl]-3H-purin-6-one

Drug info:

PubChemData

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C1[C@@H]([C@@H]1[C@@H](CO)O)CN2C=NC3=C2NC(=NC3=O)N

DOS

IR

Vibrations