Geometry & MOs

Info

ID:	210195
PubChem CID:	80773749
Reduced:	FN5C15H18 (1)
Stoich.:	AB5C15D18 (1)
Weight, g/mol:	210.128075
ΔH_f, kcal/mol:	25.19
Dipole, Da:	3.2
IP(EA), eV:	-8.72(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cyclopentyl-5-fluoro-4-N-methylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CNC1=NC=CC(=N1)N2CCN(CC2)C3=CC=CC=C3F

DOS

IR

Vibrations