Geometry & MOs

Info

ID:

180017

PubChem CID:

76567165

Reduced:

SN5O10C36H47 (1)

Stoich.:

AB5C10D36E47 (1)

Weight, g/mol:

562.261377

ΔHf, kcal/mol:

-364.91

Dipole, Da:

8.32

IP(EA), eV:

 -9.57(-0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-methyl-N-[4-[[3-propan-2-yl-1-(pyrrolidine-2-carbonyl)piperidin-4-yl]sulfamoyl]naphthalen-1-yl]benzamide

Drug info:

PubChemData

Smile

C1CCC=CC2CC2(NC(=O)C3CC(CN3C(=O)C(CC1)NC(=O)OC4CCOCC4)OC(=O)N5CC6=CC=CC=C6C5)C(=O)NS(=O)(=O)C7CC7

DOS

IR

Vibrations