Geometry & MOs

Info

ID:	67156
PubChem CID:	46505973
Reduced:	N2O3C25H36 (1)
Stoich.:	A2B3C25D36 (1)
Weight, g/mol:	507.382478
ΔH_f, kcal/mol:	-153.71
Dipole, Da:	3.78
IP(EA), eV:	-9.48(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-adamantyl)-N-[1-[3-(2-ethylpiperidin-1-yl)propylamino]-3-methyl-1-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCCOC)NC(=O)C1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations