Geometry & MOs

Info

ID:	348446
PubChem CID:	127273547
Reduced:	ON5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	23.45
Dipole, Da:	6.94
IP(EA), eV:	-8.17(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-4-benzyl-5-[3-(2,5-dimethylpyrrolidin-1-yl)piperidine-1-carbonyl]morpholin-3-one

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=NC=C(C=C2)C(=O)NC3=C4C(=C(C=C3)C)C=NN4

DOS

IR

Vibrations