Geometry & MOs

Info

ID:

114920

PubChem CID:

50501969

Reduced:

Cl2O5N6C27H32 (1)

Stoich.:

A2B5C6D27E32 (1)

Weight, g/mol:

584.251396

ΔHf, kcal/mol:

-193.28

Dipole, Da:

9.87

IP(EA), eV:

 -9.24(-0.83)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[4-chloro-3-(dimethylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-[3-[3-(methylcarbamoyl)anilino]-3-oxopropyl]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)C(=O)N(C)C)Cl

DOS

IR

Vibrations