Geometry & MOs

Info

ID:	262904
PubChem CID:	103328910
Reduced:	SN2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	303.115381
ΔH_f, kcal/mol:	82.46
Dipole, Da:	3.18
IP(EA), eV:	-8.33(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

CNC1=NC(=C2C=CSC2=N1)N(C)CCC3=CC=CS3

DOS

IR

Vibrations