Geometry & MOs

Info

ID:

110975

PubChem CID:

50346721

Reduced:

N5O5C33H43 (1)

Stoich.:

A5B5C33D43 (1)

Weight, g/mol:

589.32642

ΔHf, kcal/mol:

-190.08

Dipole, Da:

5.27

IP(EA), eV:

 -8.45(-0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(3-methoxyphenyl)-1-[1-[1-[2-methyl-3-(pyrrolidine-1-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carbonyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C(C)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC=CC=C4OC)C(=O)N5CCCC5

DOS

IR

Vibrations