Geometry & MOs

Info

ID:

422445

PubChem CID:

135117841

Reduced:

SO3N5C17H27 (1)

Stoich.:

AB3C5D17E27 (1)

Weight, g/mol:

554.199919

ΔHf, kcal/mol:

-99.89

Dipole, Da:

7.9

IP(EA), eV:

 -8.8(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-fluoro-23-methoxy-15-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]-2-oxa-10,15,19-triazatricyclo[19.2.2.03,8]pentacosa-1(23),3(8),4,6,21,24-hexaene-11,20-dione

Drug info:

PubChemData

Smile

CCNC(=O)C1=CN=C(C=C1)N2CCCN(CC2)S(=O)(=O)N3CCCC3

DOS

IR

Vibrations