Geometry & MOs

Info

ID:

92029

PubChem CID:

49982010

Reduced:

F3N5O5C32H40 (1)

Stoich.:

A3B5C5D32E40 (1)

Weight, g/mol:

632.368619

ΔHf, kcal/mol:

-366.42

Dipole, Da:

8.56

IP(EA), eV:

 -8.87(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[5-(cyclopentylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-[2-[2-methyl-4-(propylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2CCCC2)NC(=O)C(C)N3CCC(CC3)C(=O)NC(C)C(=O)NC4=CC=CC=C4OC(F)(F)F

DOS

IR

Vibrations