Geometry & MOs

Info

ID:	220991
PubChem CID:	85248145
Reduced:	N2O5C11H16 (1)
Stoich.:	A2B5C11D16 (1)
Weight, g/mol:	254.091609
ΔH_f, kcal/mol:	-191.82
Dipole, Da:	2.6
IP(EA), eV:	-10.12(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-6-anilino-3-methylidenepyrazolo[3,4-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC(C)C(C(=O)OC)NC(=O)OCC1=CN=CO1

DOS

IR

Vibrations