Geometry & MOs

Info

ID:

90158

PubChem CID:

49966958

Reduced:

N5O6C32H43 (1)

Stoich.:

A5B6C32D43 (1)

Weight, g/mol:

577.32642

ΔHf, kcal/mol:

-231.36

Dipole, Da:

5.78

IP(EA), eV:

 -8.43(-0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-methoxy-4-(propanoylamino)phenyl]-1-[2-[2-methyl-5-(4-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)NC(=O)CN3CCC(CC3)C(=O)NCC(=O)NC4=C(C=C(C=C4)OC)OC

DOS

IR

Vibrations