Geometry & MOs

Info

ID:

104930

PubChem CID:

50105984

Reduced:

FO4N5C33H38 (1)

Stoich.:

AB4C5D33E38 (1)

Weight, g/mol:

599.310769

ΔHf, kcal/mol:

-170.15

Dipole, Da:

9.88

IP(EA), eV:

 -8.69(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[4-(dimethylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-[3-[(2-methoxybenzoyl)amino]-4-methylphenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(C)C(=O)NC3=C(C=C(C=C3)C(=O)N(C)C)C)NC(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations