Geometry & MOs

Info

ID:	312486
PubChem CID:	126605790
Reduced:	ClFOSN6H16C18 (1)
Stoich.:	ABCDE6F16G18 (1)
Weight, g/mol:	221.012219
ΔH_f, kcal/mol:	65.04
Dipole, Da:	2.58
IP(EA), eV:	-8.85(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-[[3-(trifluoromethoxy)phenyl]methylidene]thiohydroxylamine

Drug info:

PubChemData

Smile

CC1CN1C(=O)C2=CN(C3=NC=C(N=C23)C(=N)C4=C(C=C(C=C4)Cl)NC)SF

DOS

IR

Vibrations