Geometry & MOs

Info

ID:

106582

PubChem CID:

50169788

Reduced:

FN5O5C30H38 (1)

Stoich.:

AB5C5D30E38 (1)

Weight, g/mol:

680.308911

ΔHf, kcal/mol:

-245.42

Dipole, Da:

3.11

IP(EA), eV:

 -8.94(-0.43)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-[4-chloro-3-(piperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]-1-[2-[2-methyl-4-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)F)NC(=O)C(C)NC(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)C(=O)N4CCOCC4)C

DOS

IR

Vibrations