Geometry & MOs

Info

ID:

118006

PubChem CID:

50624036

Reduced:

ClF2O5N6C34H35 (1)

Stoich.:

AB2C5D6E34F35 (1)

Weight, g/mol:

644.251396

ΔHf, kcal/mol:

-255.44

Dipole, Da:

7.52

IP(EA), eV:

 -9.07(-0.81)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[1-(5-carbamoyl-2-chloroanilino)-1-oxopropan-2-yl]piperidine-4-carbonyl]-N-[3-(phenylcarbamoyl)phenyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=C(C=CC(=C1)C(=O)N)Cl)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC=CC(=C4)C(=O)NC5=C(C=C(C=C5)F)F

DOS

IR

Vibrations