Geometry & MOs

Info

ID:	362829
PubChem CID:	127309658
Reduced:	N2O2C9H16 (2)
Stoich.:	A2B2C9D16 (2)
Weight, g/mol:	348.183127
ΔH_f, kcal/mol:	-179.32
Dipole, Da:	2.13
IP(EA), eV:	-8.84(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]-4-methylsulfonylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

COCCN1CCCC1CNC(=O)N2CCN(CC2)C(=O)C3CCCO3

DOS

IR

Vibrations