Geometry & MOs

Info

ID:	91177
PubChem CID:	49973855
Reduced:	N3O3C17H22 (2)
Stoich.:	A3B3C17D22 (2)
Weight, g/mol:	508.26857
ΔH_f, kcal/mol:	-238.02
Dipole, Da:	3.33
IP(EA), eV:	-8.26(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyphenyl)-1-[2-[2-methyl-5-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCOCC2)NC(=O)CN3CCC(CC3)C(=O)N4CCCC4C(=O)NC5=CC(=C(C=C5)NC(=O)C)C

DOS

IR

Vibrations