Geometry & MOs

Info

ID:

90488

PubChem CID:

49969996

Reduced:

ClO3N4C30H39 (1)

Stoich.:

AB3C4D30E39 (1)

Weight, g/mol:

582.22055

ΔHf, kcal/mol:

-134.41

Dipole, Da:

7.23

IP(EA), eV:

 -8.79(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-bromo-3-methylphenyl)-1-[1-[2-methyl-5-(4-methylpiperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)NC(=O)C(C)N3CCC(CC3)C(=O)NC4=C(C(=CC=C4)Cl)C

DOS

IR

Vibrations