Geometry & MOs

Info

ID:	330692
PubChem CID:	127248099
Reduced:	O2N5C17H25 (1)
Stoich.:	A2B5C17D25 (1)
Weight, g/mol:	330.205576
ΔH_f, kcal/mol:	-52.62
Dipole, Da:	4.66
IP(EA), eV:	-8.89(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[[3-(4-methylpiperidine-1-carbonyl)pyrazin-2-yl]methyl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)N1CCC(C1)CC2=NC=CN=C2C(=O)N3CCN(CC3)C

DOS

IR

Vibrations