Geometry & MOs

Info

ID:

49465

PubChem CID:

11533059

Reduced:

F3N4O4C23H25 (1)

Stoich.:

A3B4C4D23E25 (1)

Weight, g/mol:

478.174001

ΔHf, kcal/mol:

-272.54

Dipole, Da:

1.55

IP(EA), eV:

 -9.13(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

15,16-dimethoxy-20-(3-morpholin-4-ylpropyl)-5,7-dioxa-20-azapentacyclo[10.8.0.02,10.04,8.013,18]icosa-1(12),2,4(8),9,13,15,17-heptaene-11,19-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(C)CC1=CC=C(C=C1)N2C=NN(C2=O)CC3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations