Geometry & MOs

Info

ID:

116160

PubChem CID:

50549649

Reduced:

ClF2O4N5C28H32 (1)

Stoich.:

AB2C4D5E28F32 (1)

Weight, g/mol:

583.256147

ΔHf, kcal/mol:

-236.26

Dipole, Da:

6.11

IP(EA), eV:

 -8.88(-0.63)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(5-carbamoyl-2-methoxyphenyl)-1-[1-[4-chloro-3-(3-methylpiperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)F)F)NC(=O)C2CCN(CC2)CC(=O)NC3=CC(=C(C=C3)Cl)C(=O)N4CCCC4

DOS

IR

Vibrations