Geometry & MOs

Info

ID:

419957

PubChem CID:

135110215

Reduced:

SN3O4C14H25 (1)

Stoich.:

AB3C4D14E25 (1)

Weight, g/mol:

541.290034

ΔHf, kcal/mol:

-127.54

Dipole, Da:

4.43

IP(EA), eV:

 -9.24(0.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-15-(4-hydroxycyclohexanecarbonyl)-20-methoxy-11-propan-2-yl-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

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2O)CCCS(=O)(=O)N(C)C

DOS

IR

Vibrations