Geometry & MOs

Info

ID:	370061
PubChem CID:	127337313
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	29.72
Dipole, Da:	5.94
IP(EA), eV:	-8.77(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethylimidazol-1-yl)-N-[(1-phenylcyclopropyl)methyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCCN(C1)C2=NN=CC=C2)C(=O)NCC3(CCC3)C4=CC=CC=C4

DOS

IR

Vibrations