Geometry & MOs

Info

ID:

119105

PubChem CID:

50670185

Reduced:

ClSO4N5C34H46 (1)

Stoich.:

ABC4D5E34F46 (1)

Weight, g/mol:

607.217317

ΔHf, kcal/mol:

-178.81

Dipole, Da:

2.62

IP(EA), eV:

 -8.31(-0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-chloro-5-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]-N-[1-oxo-1-(2,3,4-trifluoroanilino)propan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C(C)N3CCC(CC3)C(=O)NC(C(C)C)C(=O)NC4=CC(=CC=C4)SC

DOS

IR

Vibrations