Geometry & MOs

Info

ID:	362570
PubChem CID:	127308302
Reduced:	FON4C22H31 (1)
Stoich.:	ABC4D22E31 (1)
Weight, g/mol:	350.268176
ΔH_f, kcal/mol:	-76.85
Dipole, Da:	3.79
IP(EA), eV:	-8.73(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-propylpyrrolidin-3-yl)methyl]-3-(pyrrolidine-1-carbonyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC(C1)CNC(=O)N2CCC(CC2)C3=CNC4=C3C=CC(=C4)F

DOS

IR

Vibrations