Geometry & MOs

Info

ID:	58637
PubChem CID:	24712376
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	259.11209
ΔH_f, kcal/mol:	-93.24
Dipole, Da:	5.09
IP(EA), eV:	-8.75(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenoxy)-6-pyrrolidin-1-ylpyrimidine

Drug info:

PubChemData

Smile

CCCN1CC2=C(C1=O)C(NC(=O)N2C)C3=CC(=CC=C3)OC

DOS

IR

Vibrations