Geometry & MOs

Info

ID:	328151
PubChem CID:	126692292
Reduced:	N2C13H17 (2)
Stoich.:	A2B13C17 (2)
Weight, g/mol:	371.141596
ΔH_f, kcal/mol:	83.54
Dipole, Da:	2.62
IP(EA), eV:	-7.94(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(1S)-2-(2-methyl-1,3-thiazol-4-yl)cyclobutyl]-1-(oxan-4-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=C(C(=NC1)C)C2=CC(=C(C(=C2)NC)NC=C)C(C)(C3CCC3)C4=CC=CCN4

DOS

IR

Vibrations