Geometry & MOs

Info

ID:	27581
PubChem CID:	822304
Reduced:	N4H8C11 (1)
Stoich.:	A4B8C11 (1)
Weight, g/mol:	286.12772
ΔH_f, kcal/mol:	108.65
Dipole, Da:	6.96
IP(EA), eV:	-9.54(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5S)-4,5-dimethoxy-1,3,7,9-tetramethylpurine-2,6,8-trione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C=NC3=NC=NC=C32

DOS

IR

Vibrations