Geometry & MOs

Info

ID:	323263
PubChem CID:	126673902
Reduced:	OC9H17 (4)
Stoich.:	AB9C17 (4)
Weight, g/mol:	277.068511
ΔH_f, kcal/mol:	-270.45
Dipole, Da:	5.0
IP(EA), eV:	-9.68(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)-1-[(E)-1-(furan-2-yl)ethylideneamino]thiourea

Drug info:

PubChemData

Smile

COCCCCCCCCCCCCCCC/C=C\1/C(C(=O)O1)CCCCCCCCCCCCCCCOC

DOS

IR

Vibrations