Geometry & MOs

Info

ID:

110974

PubChem CID:

50346720

Reduced:

O4N5C33H43 (1)

Stoich.:

A4B5C33D43 (1)

Weight, g/mol:

589.32642

ΔHf, kcal/mol:

-156.1

Dipole, Da:

2.47

IP(EA), eV:

 -8.88(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(2-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=CC(=CC=C1)NC(=O)C2CCCN2C(=O)C3CCN(CC3)C(C)C(=O)NC4=CC=CC(=C4C)C(=O)N5CCCC5

DOS

IR

Vibrations