Geometry & MOs

Info

ID:	231456
PubChem CID:	87573773
Reduced:	ClF2N2O4H19C20 (1)
Stoich.:	AB2C2D4E19F20 (1)
Weight, g/mol:	194.037706
ΔH_f, kcal/mol:	-219.62
Dipole, Da:	6.13
IP(EA), eV:	-9.47(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethylphenyl)-trifluoro-lambda4-sulfane

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=C(C(=NC(=C1F)C2=CC=C(C=C2)Cl)C(=O)OC)/C=C/F

DOS

IR

Vibrations