Geometry & MOs

Info

ID:

116303

PubChem CID:

50555852

Reduced:

ClN4O4C27H35 (1)

Stoich.:

AB4C4D27E35 (1)

Weight, g/mol:

651.242389

ΔHf, kcal/mol:

-147.61

Dipole, Da:

3.27

IP(EA), eV:

 -9.03(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[4-chloro-3-(piperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]-N-[4-[(2,6-difluorophenyl)carbamoyl]phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)C2CCN(CC2)CC(=O)NC3=CC(=C(C=C3)Cl)C(=O)NCC(C)C

DOS

IR

Vibrations