Geometry & MOs

Info

ID:

418128

PubChem CID:

135103635

Reduced:

ClO2N3C20H28 (1)

Stoich.:

AB2C3D20E28 (1)

Weight, g/mol:

520.243418

ΔHf, kcal/mol:

-90.63

Dipole, Da:

3.82

IP(EA), eV:

 -9.09(-0.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-20-methoxy-11-propan-2-yl-15-(pyridine-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

CN1C[C@@H]2C[C@@H](C[C@@H]2CC1=O)N(C)CC(=O)NCCC3=CC(=CC=C3)Cl

DOS

IR

Vibrations