Geometry & MOs

Info

ID:

95391

PubChem CID:

50008941

Reduced:

FO4N5C29H36 (1)

Stoich.:

AB4C5D29E36 (1)

Weight, g/mol:

565.290034

ΔHf, kcal/mol:

-201.69

Dipole, Da:

8.36

IP(EA), eV:

 -8.77(-0.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(2,5-dimethoxyphenyl)-1-[1-[2-[2-methyl-5-(methylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carbonyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2CCCN2C(=O)C3CCN(CC3)CC(=O)NC4=C(C=CC(=C4)C(=O)NC)C)F

DOS

IR

Vibrations