Geometry & MOs

Info

ID:	262913
PubChem CID:	103329335
Reduced:	SF2N4C9H10 (1)
Stoich.:	AB2C4D9E10 (1)
Weight, g/mol:	292.135782
ΔH_f, kcal/mol:	-46.97
Dipole, Da:	4.19
IP(EA), eV:	-8.36(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-4-N-methyl-4-N-(2-methyloxolan-3-yl)thieno[2,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CNC1=NC(=C2C=CSC2=N1)NCC(F)F

DOS

IR

Vibrations