Geometry & MOs

Info

ID:	425446
PubChem CID:	135126360
Reduced:	NO2F3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	543.355988
ΔH_f, kcal/mol:	-241.83
Dipole, Da:	6.22
IP(EA), eV:	-8.57(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(18Z)-13,19,21,27-tetramethyl-17-prop-2-enyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone

Drug info:

PubChemData

Smile

COC(=O)CC1CCN(CC1)C2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations