Geometry & MOs

Info

ID:	266480
PubChem CID:	103567373
Reduced:	NSO3C15H21 (1)
Stoich.:	ABC3D15E21 (1)
Weight, g/mol:	229.057278
ΔH_f, kcal/mol:	-107.4
Dipole, Da:	7.16
IP(EA), eV:	-8.46(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-fluoroethoxy)-5-methoxybenzenecarbothioamide

Drug info:

PubChemData

Smile

COC1CCCC(C1)OC2=CC(=CC(=C2)OC)C(=S)N

DOS

IR

Vibrations