Geometry & MOs

Info

ID:	262927
PubChem CID:	103329787
Reduced:	SO2N5C13H17 (1)
Stoich.:	AB2C5D13E17 (1)
Weight, g/mol:	307.146681
ΔH_f, kcal/mol:	-33.37
Dipole, Da:	2.11
IP(EA), eV:	-8.71(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[6-methyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOCC1)NC2=C3C=CSC3=NC(=N2)N

DOS

IR

Vibrations