Geometry & MOs

Info

ID:	262886
PubChem CID:	103326781
Reduced:	FSN4C15H15 (1)
Stoich.:	ABC4D15E15 (1)
Weight, g/mol:	302.100146
ΔH_f, kcal/mol:	23.15
Dipole, Da:	4.01
IP(EA), eV:	-8.33(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-4-N-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCN(C1=CC(=CC=C1)F)C2=C3C=C(SC3=NC(=N2)N)C

DOS

IR

Vibrations