Geometry & MOs

Info

ID:	367479
PubChem CID:	127324810
Reduced:	N3O4C20H35 (1)
Stoich.:	A3B4C20D35 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-193.79
Dipole, Da:	2.62
IP(EA), eV:	-8.68(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-4-phenylpyrrolidin-1-yl)-3-[4-(oxolane-2-carbonyl)piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CN(C1CCC(CC1)OC)C(=O)CCN2CCN(CC2)C(=O)C3CCCO3

DOS

IR

Vibrations