Geometry & MOs

Info

ID:

115720

PubChem CID:

50531955

Reduced:

ClF2O4N5C34H36 (1)

Stoich.:

AB2C4D5E34F36 (1)

Weight, g/mol:

529.209197

ΔHf, kcal/mol:

-220.0

Dipole, Da:

9.21

IP(EA), eV:

 -8.85(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-(3-carbamoyl-4-chloroanilino)-1-oxopropan-2-yl]-N-[5-(dimethylcarbamoyl)-2-methoxyphenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)NC(=O)CN3CCC(CC3)C(=O)NC4=CC=CC=C4C(=O)NC5=C(C=CC(=C5)F)F)Cl

DOS

IR

Vibrations