Geometry & MOs

Info

ID:	262951
PubChem CID:	103330779
Reduced:	OSN4C13H20 (1)
Stoich.:	ABC4D13E20 (1)
Weight, g/mol:	287.120467
ΔH_f, kcal/mol:	-10.53
Dipole, Da:	3.97
IP(EA), eV:	-8.21(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-4-(2-ethylimidazol-1-yl)-N-methylthieno[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC1=CC2=C(N=C(N=C2S1)NC)NCC(C)OC

DOS

IR

Vibrations