Geometry & MOs

Info

ID:

184432

PubChem CID:

77159693

Reduced:

N2F3O5C16H25 (1)

Stoich.:

A2B3C5D16E25 (1)

Weight, g/mol:

470.196548

ΔHf, kcal/mol:

-415.2

Dipole, Da:

2.56

IP(EA), eV:

 -9.81(0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[(4-fluorophenyl)methyl]-10-hydroxy-3-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N-methyl-12-oxo-4-oxa-1,8-diazatricyclo[7.3.1.05,13]trideca-5(13),6,8,10-tetraene-11-carboxamide

Drug info:

PubChemData

Smile

CC(COC12CCN(C1CN(C2)C(=O)OC(C)(C)C)C(=O)O)C(F)(F)F

DOS

IR

Vibrations