Geometry & MOs

Info

ID:	287715
PubChem CID:	104252674
Reduced:	ON3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	277.124883
ΔH_f, kcal/mol:	-35.79
Dipole, Da:	5.0
IP(EA), eV:	-9.6(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-2-(oxan-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1CCOC(C1)CC2=NC=C3C(CCCC3=N2)N

DOS

IR

Vibrations