Geometry & MOs

Info

ID:	425818
PubChem CID:	135128146
Reduced:	O3H10C14 (1)
Stoich.:	A3B10C14 (1)
Weight, g/mol:	333.071802
ΔH_f, kcal/mol:	24.92
Dipole, Da:	3.41
IP(EA), eV:	-9.71(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-[(3-methyl-1,2-thiazol-5-yl)amino]thieno[3,2-d]pyrimidin-4-yl]amino]cyclobutan-1-ol

Drug info:

PubChemData

Smile

C#CC1=CC(=CC(=C1)C(=O)OC2CCO2)C#C

DOS

IR

Vibrations