Geometry & MOs

Info

ID:

422242

PubChem CID:

135117481

Reduced:

N3O3C14H18 (2)

Stoich.:

A3B3C14D18 (2)

Weight, g/mol:

600.269633

ΔHf, kcal/mol:

-156.95

Dipole, Da:

7.15

IP(EA), eV:

 -8.98(-0.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-20-methoxy-15-(2-methoxyquinoline-4-carbonyl)-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=C(C(=NO1)C)CC(=O)N2CCOC3=C(C=CC(=C3)C4=NC=CN4CCNC(=O)[C@H](NC(=O)C2)C(C)C)OC

DOS

IR

Vibrations