Geometry & MOs

Info

ID:

147482

PubChem CID:

53787138

Reduced:

ON3C16H22 (2)

Stoich.:

AB3C16D22 (2)

Weight, g/mol:

632.313138

ΔHf, kcal/mol:

-56.8

Dipole, Da:

4.01

IP(EA), eV:

 -9.66(-0.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

ethyl 2-[(2-ethoxy-2-oxoethyl)-[2-hydroxy-3-propan-2-yl-5-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoyl]amino]acetate

Drug info:

PubChemData

Smile

C1CCC(CC1)[C@@H](C(=O)NCC2=CC=C(C=C2)C(=N)N)NC(=O)C(CC3=CC=C(C=C3)C(=N)N)C4CCCCC4

DOS

IR

Vibrations