Geometry & MOs

Info

ID:

91376

PubChem CID:

49975478

Reduced:

FN5O5C31H40 (1)

Stoich.:

AB5C5D31E40 (1)

Weight, g/mol:

646.347883

ΔHf, kcal/mol:

-243.41

Dipole, Da:

9.47

IP(EA), eV:

 -8.91(-0.37)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-methyl-5-(morpholine-4-carbonyl)anilino]-2-oxoethyl]-N-[2-[3-(4-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C)C(=O)NC1=CC(=C(C=C1)F)NC(=O)C2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C

DOS

IR

Vibrations