Geometry & MOs

Info

ID:	370038
PubChem CID:	127337255
Reduced:	ClON5C19H24 (1)
Stoich.:	ABC5D19E24 (1)
Weight, g/mol:	361.284161
ΔH_f, kcal/mol:	-2.18
Dipole, Da:	4.32
IP(EA), eV:	-8.51(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethylimidazol-1-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)NC(C)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations