Geometry & MOs

Info

ID:

186957

PubChem CID:

77508165

Reduced:

SN4O4C26H38 (1)

Stoich.:

AB4C4D26E38 (1)

Weight, g/mol:

571.289365

ΔHf, kcal/mol:

-151.13

Dipole, Da:

2.65

IP(EA), eV:

 -8.35(-0.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[cyclopropyl-[[3-(2-methoxyethoxy)-5-(3-methoxypropyl)phenyl]methyl]carbamoyl]-4-hydroxy-4-(1-methyl-2-oxopyridin-4-yl)piperidine-1-carboxylic acid

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2=CC=C(C=C2)C(=O)NC(CC(C)C)C(=O)N3CC(C4C3C(=O)CO4)SC

DOS

IR

Vibrations