Geometry & MOs

Info

ID:	290790
PubChem CID:	110910307
Reduced:	N2O2C15H24 (1)
Stoich.:	A2B2C15D24 (1)
Weight, g/mol:	302.117904
ΔH_f, kcal/mol:	-105.99
Dipole, Da:	3.78
IP(EA), eV:	-9.12(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-5-(2-hydroxy-2-methylpropyl)pyrazolo[3,4-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CCN(CCO)C(=O)NCC1=C(C=C(C=C1C)C)C

DOS

IR

Vibrations