Geometry & MOs

Info

ID:	106852
PubChem CID:	50179061
Reduced:	BrO3N4C28H35 (1)
Stoich.:	AB3C4D28E35 (1)
Weight, g/mol:	520.304956
ΔH_f, kcal/mol:	-116.2
Dipole, Da:	6.54
IP(EA), eV:	-8.79(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC(=O)CN3CCC(CC3)C(=O)NC4=CC=CC=C4Br)C

DOS

IR

Vibrations