Geometry & MOs

Info

ID:	305547
PubChem CID:	124959366
Reduced:	ON5C19H23 (1)
Stoich.:	AB5C19D23 (1)
Weight, g/mol:	337.19026
ΔH_f, kcal/mol:	24.5
Dipole, Da:	6.0
IP(EA), eV:	-8.64(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-pyrazin-2-ylpiperidin-1-yl]-(2-pyrrolidin-1-ylpyridin-4-yl)methanone

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC=CC(=C2)C(=O)N3CCC[C@@H](C3)C4=NC=CN=C4

DOS

IR

Vibrations