Geometry & MOs

Info

ID:	343860
PubChem CID:	127267036
Reduced:	SO2N4C16H16 (1)
Stoich.:	AB2C4D16E16 (1)
Weight, g/mol:	290.117904
ΔH_f, kcal/mol:	1.71
Dipole, Da:	2.04
IP(EA), eV:	-8.86(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[(5-fluoro-2,6-dimethylpyrimidin-4-yl)amino]methyl]pyridine-2-carboxylate

Drug info:

PubChemData

Smile

CCC1=NC(=C2C=CSC2=N1)NCC3=CC(=NC=C3)C(=O)OC

DOS

IR

Vibrations