Geometry & MOs

Info

ID:	218142
PubChem CID:	85088945
Reduced:	ClN3O3H20C24 (1)
Stoich.:	AB3C3D20E24 (1)
Weight, g/mol:	434.055146
ΔH_f, kcal/mol:	-19.24
Dipole, Da:	3.92
IP(EA), eV:	-8.36(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,7,8,8,9,9,10,10,11,11,12,12,12-tridecafluorododec-4-ene-1,2-diol

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(C2=C1C(=NNC3=CC=CC=C3)C(=O)C=C2)C4=CC(=CC=C4)Cl)C

DOS

IR

Vibrations