Geometry & MOs

Info

ID:	213355
PubChem CID:	81063524
Reduced:	SF2N2O4C12H16 (1)
Stoich.:	AB2C2D4E12F16 (1)
Weight, g/mol:	294.241962
ΔH_f, kcal/mol:	-237.34
Dipole, Da:	4.0
IP(EA), eV:	-9.47(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyethyl)-N-methyl-2-propan-2-yl-4-[(propan-2-ylamino)methyl]pyrimidin-5-amine

Drug info:

PubChemData

Smile

CCOCCN(C)C(=O)C1=CC(=C(C=C1F)F)S(=O)(=O)N

DOS

IR

Vibrations