Geometry & MOs

Info

ID:

119594

PubChem CID:

50692263

Reduced:

ClO3N4C28H35 (1)

Stoich.:

AB3C4D28E35 (1)

Weight, g/mol:

720.376597

ΔHf, kcal/mol:

-125.6

Dipole, Da:

9.06

IP(EA), eV:

 -8.81(-0.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-chloro-5-(cyclopentylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-[3-methyl-1-[4-(4-methylpiperidine-1-carbonyl)anilino]-1-oxobutan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)C2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)C(=O)N4CCCCC4)Cl)C

DOS

IR

Vibrations