Geometry & MOs

Info

ID:	356897
PubChem CID:	127292501
Reduced:	O2N4C23H34 (1)
Stoich.:	A2B4C23D34 (1)
Weight, g/mol:	391.294725
ΔH_f, kcal/mol:	-81.47
Dipole, Da:	5.23
IP(EA), eV:	-8.85(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclohexylcarbamoylamino)-N-(1-prop-2-enylpiperidin-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC(=O)NC3CCN(CC3)CC=C)C

DOS

IR

Vibrations