Geometry & MOs

Info

ID:

186898

PubChem CID:

77502358

Reduced:

SCl2N4O11C32H38 (1)

Stoich.:

AB2C4D11E32F38 (1)

Weight, g/mol:

282.067428

ΔHf, kcal/mol:

-415.04

Dipole, Da:

9.45

IP(EA), eV:

 -9.17(-0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-ethyl-2-oxo-8-oxa-2lambda4-thia-12,13-diazatricyclo[7.3.1.05,10]trideca-1(12),5,9(13)-triene-7,11-dione;methane

Drug info:

PubChemData

Smile

CC1C(OCC(N1C(=O)OCOC(=O)CN(C)CCOC(=O)C2=CC(=C(C=C2NCC3=CC=CO3)Cl)S(=O)(=O)N)(C)C)(C4=CC(=CC=C4)Cl)O

DOS

IR

Vibrations