Geometry & MOs

Info

ID:

119938

PubChem CID:

50707868

Reduced:

Cl2O5N6C31H32 (1)

Stoich.:

A2B5C6D31E32 (1)

Weight, g/mol:

652.196774

ΔHf, kcal/mol:

-161.19

Dipole, Da:

9.06

IP(EA), eV:

 -9.05(-0.93)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-chloro-5-(methylcarbamoyl)anilino]-2-oxoethyl]-N-[2-[2-chloro-5-[(2-methylphenyl)carbamoyl]anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC3=C(C=CC(=C3)C(=O)NC4=CC=CC=C4)Cl

DOS

IR

Vibrations