Geometry & MOs

Info

ID:

114917

PubChem CID:

50501963

Reduced:

BrClO4N5C24H27 (1)

Stoich.:

ABC4D5E24F27 (1)

Weight, g/mol:

570.235746

ΔHf, kcal/mol:

-144.05

Dipole, Da:

6.35

IP(EA), eV:

 -9.1(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-(3-carbamoyl-4-chloroanilino)-1-oxopropan-2-yl]-N-[2-[4-(dimethylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)Cl)C(=O)N)N2CCC(CC2)C(=O)NCC(=O)NC3=CC=C(C=C3)Br

DOS

IR

Vibrations