Geometry & MOs

Info

ID:

111030

PubChem CID:

50348847

Reduced:

ClO5N6C36H43 (1)

Stoich.:

AB5C6D36E43 (1)

Weight, g/mol:

580.300933

ΔHf, kcal/mol:

-188.76

Dipole, Da:

11.39

IP(EA), eV:

 -8.61(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(5-carbamoyl-2-methoxyanilino)-2-oxoethyl]-1-[1-[2-methyl-3-(propylcarbamoyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)C1=C(C(=CC=C1)NC(=O)C(C)N2CCC(CC2)C(=O)NCC(=O)NC3=CC(=C(C=C3)C(=O)NC4=CC=CC=C4C)Cl)C

DOS

IR

Vibrations