Geometry & MOs

Info

ID:	311012
PubChem CID:	126588807
Reduced:	FNSO3C18H20 (1)
Stoich.:	ABCD3E18F20 (1)
Weight, g/mol:	353.065256
ΔH_f, kcal/mol:	-119.7
Dipole, Da:	5.47
IP(EA), eV:	-8.65(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-methyl N-[3-chloro-2-[(4-ethyl-2-fluorophenoxy)methyl]phenyl]carbamothioate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2OC)NC(=S)OC)F

DOS

IR

Vibrations