Geometry & MOs

Info

ID:	262986
PubChem CID:	103332811
Reduced:	OSN3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	291.140533
ΔH_f, kcal/mol:	-17.63
Dipole, Da:	3.91
IP(EA), eV:	-8.54(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-ethylcyclohexyl)oxy-6-methylthieno[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCC1CCCC(C1)OC2=C3C=CSC3=NC(=N2)N

DOS

IR

Vibrations