Geometry & MOs

Info

ID:

187562

PubChem CID:

77592468

Reduced:

FO2N4C19H19 (1)

Stoich.:

AB2C4D19E19 (1)

Weight, g/mol:

434.15902

ΔHf, kcal/mol:

-46.29

Dipole, Da:

6.56

IP(EA), eV:

 -9.01(-0.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[8-amino-19-ethyl-10-(methylamino)-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-19-yl] acetate

Drug info:

PubChemData

Smile

CC(C(=O)C1(C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3F)C)N)N

DOS

IR

Vibrations