Geometry & MOs

Info

ID:

96313

PubChem CID:

50019715

Reduced:

O5N6C36H50 (1)

Stoich.:

A5B6C36D50 (1)

Weight, g/mol:

577.362805

ΔHf, kcal/mol:

-205.91

Dipole, Da:

7.13

IP(EA), eV:

-8.84(-0.52)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[1-[5-(diethylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-[1-oxo-1-(4-propan-2-ylanilino)propan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)C)NC(=O)C(C)N2CCC(CC2)C(=O)NCC(=O)NC3=CC=CC=C3C(=O)N4CCC(CC4)C

DOS

IR

Vibrations