Geometry & MOs

Info

ID:	56174
PubChem CID:	17422345
Reduced:	OSF3N5C19H24 (1)
Stoich.:	ABC3D5E19F24 (1)
Weight, g/mol:	271.077933
ΔH_f, kcal/mol:	-145.98
Dipole, Da:	8.03
IP(EA), eV:	-9.36(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)thieno[3,2-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC(F)(F)F

DOS

IR

Vibrations