Geometry & MOs

Info

ID:

95705

PubChem CID:

50012836

Reduced:

FO5N6C30H39 (1)

Stoich.:

AB5C6D30E39 (1)

Weight, g/mol:

592.337319

ΔHf, kcal/mol:

-246.11

Dipole, Da:

11.66

IP(EA), eV:

 -8.6(-0.38)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[5-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]-N-[1-[2-methyl-3-(methylcarbamoyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)C)NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC3=C(C=CC(=C3)NC(=O)C)F

DOS

IR

Vibrations