Geometry & MOs

Info

ID:	262885
PubChem CID:	103326666
Reduced:	OSN4C14H18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	302.100146
ΔH_f, kcal/mol:	5.73
Dipole, Da:	1.62
IP(EA), eV:	-8.61(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC2C(C1)N(CCO2)C3=C4C=CSC4=NC(=N3)N

DOS

IR

Vibrations