Geometry & MOs

Info

ID:

164402

PubChem CID:

74395539

Reduced:

N3O3C41H53 (1)

Stoich.:

A3B3C41D53 (1)

Weight, g/mol:

550.341815

ΔHf, kcal/mol:

-126.99

Dipole, Da:

2.32

IP(EA), eV:

 -8.97(-0.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[10-(2-fluoroethoxy)-5-methoxy-7,10,12,15-tetramethyl-11-oxo-8-tricyclo[5.5.3.01,6]pentadecanyl] N-(1-azabicyclo[2.2.1]heptane-3-carbonyl)carbamate

Drug info:

PubChemData

Smile

CCCCN(C)C(=O)C(C1=CC=CC=C1)NC(=O)C23CCC(CC2)(CC3)CNC(=O)C4=CC=CC(=C4C5=CC=C(C=C5)C(C)(C)C)C

DOS

IR

Vibrations