Geometry & MOs

Info

ID:	432640
PubChem CID:	135172776
Reduced:	N2O3C8H10 (1)
Stoich.:	A2B3C8D10 (1)
Weight, g/mol:	291.133139
ΔH_f, kcal/mol:	-70.31
Dipole, Da:	4.66
IP(EA), eV:	-10.23(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[9-(oxan-2-yl)purin-6-yl]amino]acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)COC1=CN=NC=C1

DOS

IR

Vibrations