Geometry & MOs

Info

ID:	139522
PubChem CID:	52548131
Reduced:	SN2O3C24H24 (1)
Stoich.:	AB2C3D24E24 (1)
Weight, g/mol:	334.98133
ΔH_f, kcal/mol:	-32.22
Dipole, Da:	8.86
IP(EA), eV:	-8.72(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-bromo-4-fluorophenyl)methyl N,N-diethylcarbamodithioate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)N(CC=C)C3=CC=CC=C3

DOS

IR

Vibrations