Geometry & MOs

Info

ID:

232605

PubChem CID:

87576505

Reduced:

N2O3C36H72 (1)

Stoich.:

A2B3C36D72 (1)

Weight, g/mol:

733.279292

ΔHf, kcal/mol:

-288.53

Dipole, Da:

2.3

IP(EA), eV:

 -9.77(0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(1S,4R,6S,7E,14S,18R)-4-(cyclopropylsulfonylcarbamoyl)-14-[(2-methylpropan-2-yl)oxycarbonylamino]-2,15-dioxo-11-oxa-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-en-18-yl] 4-fluoro-1,3-dihydroisoindole-2-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCN[C@@H](CC(=O)O)C(=O)NCCCCCCCCCCCCCCCC

DOS

IR

Vibrations