Geometry & MOs

Info

ID:	233548
PubChem CID:	91145423
Reduced:	O2N5C20H27 (1)
Stoich.:	A2B5C20D27 (1)
Weight, g/mol:	238.028678
ΔH_f, kcal/mol:	70.69
Dipole, Da:	7.8
IP(EA), eV:	-9.27(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,1,1,3-tetrafluoro-3-methylpentan-2-yl) hydrogen sulfite

Drug info:

PubChemData

Smile

CC(CC=C)NC12C=C1C3=CN(CCCC4CC4(NCC2=O)C(=O)C)N=N3

DOS

IR

Vibrations