Geometry & MOs

Info

ID:

106955

PubChem CID:

50182604

Reduced:

O4N5C34H45 (1)

Stoich.:

A4B5C34D45 (1)

Weight, g/mol:

547.315855

ΔHf, kcal/mol:

-165.4

Dipole, Da:

5.05

IP(EA), eV:

 -9.09(-0.52)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC(=O)CN3CCC(CC3)C(=O)NC4=C(C=CC=C4C(=O)N5CCCC5)C)C

DOS

IR

Vibrations