Geometry & MOs

Info

ID:

118587

PubChem CID:

50648191

Reduced:

ClSO4N5C30H40 (1)

Stoich.:

ABC4D5E30F40 (1)

Weight, g/mol:

585.271797

ΔHf, kcal/mol:

-172.77

Dipole, Da:

8.13

IP(EA), eV:

 -8.46(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-chloro-5-(2-methylpropylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-[1-(3-methoxyanilino)-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C)N2CCC(CC2)C(=O)NC(C)C(=O)NC3=CC(=CC=C3)SC

DOS

IR

Vibrations