Geometry & MOs

Info

ID:

192304

PubChem CID:

78254512

Reduced:

ClSO4N5H18C22 (1)

Stoich.:

ABC4D5E18F22 (1)

Weight, g/mol:

483.199191

ΔHf, kcal/mol:

-6.65

Dipole, Da:

2.94

IP(EA), eV:

 -8.98(-1.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-(4-propan-2-ylphenyl)-4a,5,6,7,8,8a-hexahydro-1H-chromeno[2,3-c]pyrrole-3,9-dione

Drug info:

PubChemData

Smile

C1COCCN1C(=O)C=C2NN3C(=N)C(=CC4=CC=C(O4)C5=CC=C(C=C5)Cl)C(=O)N=C3S2

DOS

IR

Vibrations