Geometry & MOs

Info

ID:	82482
PubChem CID:	49856086
Reduced:	O3N4C26H36 (1)
Stoich.:	A3B4C26D36 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-80.93
Dipole, Da:	2.75
IP(EA), eV:	-8.67(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[4-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]-2-oxoethyl]piperazin-2-one

Drug info:

PubChemData

Smile

C[C@@H]1CCCN1CCCOC2=CC=C(C=C2)C(=O)CN3CCN(CC3)C(=O)C4=CC=CN4C

DOS

IR

Vibrations