Geometry & MOs

Info

ID:

95292

PubChem CID:

50007887

Reduced:

ClO4N5C30H32 (1)

Stoich.:

AB4C5D30E32 (1)

Weight, g/mol:

575.229932

ΔHf, kcal/mol:

-119.72

Dipole, Da:

4.1

IP(EA), eV:

 -8.88(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-chloro-2-[(2-methylphenyl)carbamoyl]phenyl]-1-[2-[2-methyl-5-(methylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations