Geometry & MOs

Info

ID:

418264

PubChem CID:

135104027

Reduced:

SN3O6C18H27 (1)

Stoich.:

AB3C6D18E27 (1)

Weight, g/mol:

526.199839

ΔHf, kcal/mol:

-246.33

Dipole, Da:

4.33

IP(EA), eV:

 -9.35(-0.92)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-20-methoxy-11-propan-2-yl-15-(1,3-thiazole-4-carbonyl)-18-oxa-3,6,9,12,15-pentazatricyclo[17.3.1.02,6]tricosa-1(23),2,4,19,21-pentaene-10,13-dione

Drug info:

PubChemData

Smile

C[C@@]1(CC2(CCNCC2)OC[C@@H]1O)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC

DOS

IR

Vibrations