Geometry & MOs

Info

ID:

106960

PubChem CID:

50183000

Reduced:

FN6O6C33H43 (1)

Stoich.:

AB6C6D33E43 (1)

Weight, g/mol:

590.321668

ΔHf, kcal/mol:

-290.71

Dipole, Da:

8.82

IP(EA), eV:

 -8.86(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(4-acetamidoanilino)-2-oxoethyl]-1-[1-[4-(cyclopentylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N2CCOCC2)NC(=O)CN3CCC(CC3)C(=O)NC(C)C(=O)NC4=CC(=C(C=C4)F)NC(=O)C(C)C

DOS

IR

Vibrations