Geometry & MOs

Info

ID:

107403

PubChem CID:

50201647

Reduced:

ClO5N6C34H47 (1)

Stoich.:

AB5C6D34E47 (1)

Weight, g/mol:

674.298346

ΔHf, kcal/mol:

-224.04

Dipole, Da:

8.41

IP(EA), eV:

 -8.84(-0.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-[4-chloro-2-(phenylcarbamoyl)anilino]-1-oxopropan-2-yl]-1-[2-[4-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC(C)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)N(CC)CC)C

DOS

IR

Vibrations