Geometry & MOs

Info

ID:	214123
PubChem CID:	81067394
Reduced:	SO3N4C11H22 (1)
Stoich.:	AB3C4D11E22 (1)
Weight, g/mol:	242.154289
ΔH_f, kcal/mol:	-91.79
Dipole, Da:	2.04
IP(EA), eV:	-9.26(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-N,4-N-dimethyl-4-N-(2-propan-2-yloxyethyl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCNCC1=C(NN=C1)S(=O)(=O)N(C)CCOCC

DOS

IR

Vibrations