Geometry & MOs

Info

ID:	262922
PubChem CID:	103329721
Reduced:	SO2N5C12H15 (1)
Stoich.:	AB2C5D12E15 (1)
Weight, g/mol:	293.131031
ΔH_f, kcal/mol:	-33.08
Dipole, Da:	3.93
IP(EA), eV:	-8.4(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]-N-(2-methylpropyl)acetamide

Drug info:

PubChemData

Smile

COC(=O)NC1CCN(C1)C2=C3C=CSC3=NC(=N2)N

DOS

IR

Vibrations