Geometry & MOs

Info

ID:	370202
PubChem CID:	127337716
Reduced:	ON5C18H29 (1)
Stoich.:	AB5C18D29 (1)
Weight, g/mol:	318.241962
ΔH_f, kcal/mol:	-35.08
Dipole, Da:	2.56
IP(EA), eV:	-8.57(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethylimidazol-1-yl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)NC2CCCN(C2)C3=NN=C(C=C3)C

DOS

IR

Vibrations