Geometry & MOs

Info

ID:	361877
PubChem CID:	127304871
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-11.94
Dipole, Da:	7.81
IP(EA), eV:	-8.74(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethylphenyl)-4-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CCN(C(C1)CN2CCOCC2)C(=O)C3=CN4C=NN=C4C=C3

DOS

IR

Vibrations