Geometry & MOs

Info

ID:	329984
PubChem CID:	127246971
Reduced:	FON4C19H21 (1)
Stoich.:	ABC4D19E21 (1)
Weight, g/mol:	327.169525
ΔH_f, kcal/mol:	-8.42
Dipole, Da:	5.61
IP(EA), eV:	-8.77(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethoxypyridin-3-yl)-[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CNC1=NC(=CN=C1)C2CCCN2C(=O)C3(CC3)C4=CC=CC=C4F

DOS

IR

Vibrations