Geometry & MOs

Info

ID:	329864
PubChem CID:	127246731
Reduced:	ON5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	329.153955
ΔH_f, kcal/mol:	29.58
Dipole, Da:	6.71
IP(EA), eV:	-8.53(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-fluoro-4-methoxyphenyl)-[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C(=O)C3=CN(N=C3)C

DOS

IR

Vibrations