Geometry & MOs

Info

ID:

91193

PubChem CID:

49973989

Reduced:

BrN4O4C28H35 (1)

Stoich.:

AB4C4D28E35 (1)

Weight, g/mol:

740.345296

ΔHf, kcal/mol:

-145.28

Dipole, Da:

4.65

IP(EA), eV:

 -9.27(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(3-benzamido-4-chlorophenyl)-1-[1-[1-[2-methyl-5-(4-methylpiperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carbonyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCOCC2)NC(=O)CN3CCC(CC3)C(=O)NC4=C(C=C(C=C4C)Br)C

DOS

IR

Vibrations