Geometry & MOs

Info

ID:	356831
PubChem CID:	127292371
Reduced:	ON5C19H33 (1)
Stoich.:	AB5C19D33 (1)
Weight, g/mol:	319.237211
ΔH_f, kcal/mol:	-50.23
Dipole, Da:	4.58
IP(EA), eV:	-8.61(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-imidazol-2-yl)-N-[(1-propylpyrrolidin-3-yl)methyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(C)(C)CNC(=O)N2CCCCC2C3=NC=CN3

DOS

IR

Vibrations