Geometry & MOs

Info

ID:	262967
PubChem CID:	103331531
Reduced:	SO2N3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	279.140533
ΔH_f, kcal/mol:	-56.49
Dipole, Da:	3.9
IP(EA), eV:	-8.25(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-4-(4-methylpentan-2-yloxy)thieno[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC1=CC2=C(N=C(N=C2S1)NCC)OCC3CCCO3

DOS

IR

Vibrations