Geometry & MOs

Info

ID:	358688
PubChem CID:	127296478
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	221.132826
ΔH_f, kcal/mol:	52.55
Dipole, Da:	5.74
IP(EA), eV:	-9.11(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2,4-dimethyl-6-(4-methylidenepiperidin-1-yl)pyrimidine

Drug info:

PubChemData

Smile

COCC1=NC2=NC=NN2C(=C1)N3CCC(=C)CC3

DOS

IR

Vibrations