Geometry & MOs

Info

ID:

420425

PubChem CID:

135113058

Reduced:

ON2C12H14 (2)

Stoich.:

AB2C12D14 (2)

Weight, g/mol:

595.300599

ΔHf, kcal/mol:

-45.64

Dipole, Da:

2.68

IP(EA), eV:

 -9.17(-0.72)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-20-methoxy-11-propan-2-yl-15-[(2,3,4-trimethoxyphenyl)methyl]-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

C1CCN(C(=O)C1)CC(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)C5=CC=CC=C5

DOS

IR

Vibrations