Geometry & MOs

Info

ID:

106164

PubChem CID:

50151090

Reduced:

O3N4C31H42 (1)

Stoich.:

A3B4C31D42 (1)

Weight, g/mol:

601.362805

ΔHf, kcal/mol:

-127.65

Dipole, Da:

6.05

IP(EA), eV:

 -8.74(-0.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)NC(=O)CN3CCC(CC3)C(=O)NC4=CC=C(C=C4)C(C)C)C

DOS

IR

Vibrations