Geometry & MOs

Info

ID:

420253

PubChem CID:

135112098

Reduced:

FN2S2O5C14H21 (1)

Stoich.:

AB2C2D5E14F21 (1)

Weight, g/mol:

586.210674

ΔHf, kcal/mol:

-230.21

Dipole, Da:

4.32

IP(EA), eV:

 -9.69(-1.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(14R)-20-[2-(3-chloro-4-fluorophenoxy)acetyl]-8,14-dimethyl-5-oxa-1,13,16,20,23,24-hexazatricyclo[20.2.1.06,11]pentacosa-6(11),7,9,22(25),23-pentaene-12,15-dione

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N[C@H]2COC[C@H]2CS(=O)(=O)N(C)C)F

DOS

IR

Vibrations