Geometry & MOs

Info

ID:

418083

PubChem CID:

135103492

Reduced:

N2O3C24H26 (1)

Stoich.:

A2B3C24D26 (1)

Weight, g/mol:

561.244815

ΔHf, kcal/mol:

-70.11

Dipole, Da:

5.73

IP(EA), eV:

 -8.48(-0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-20-methoxy-11-propan-2-yl-15-([1,2,4]triazolo[1,5-a]pyrimidine-2-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=CC2=C1C=C(C=C2)C(=O)N3CCC4(CC3)C5=C(CCO4)C=C(C=C5)OC

DOS

IR

Vibrations