Geometry & MOs

Info

ID:	330588
PubChem CID:	127247995
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	297.205242
ΔH_f, kcal/mol:	6.71
Dipole, Da:	4.74
IP(EA), eV:	-8.94(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R,4R)-3-hydroxy-4-morpholin-4-ylpyrrolidin-1-yl]-2-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

CN1C=CC=C1C(=O)N2CCCC2C3=NC=C(C=C3)CN4CCCC4

DOS

IR

Vibrations