Geometry & MOs

Info

ID:	8760
PubChem CID:	81296
Reduced:	NO2S2C13H19 (1)
Stoich.:	AB2C2D13E19 (1)
Weight, g/mol:	285.085721
ΔH_f, kcal/mol:	-67.07
Dipole, Da:	3.16
IP(EA), eV:	-8.57(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[bis(ethylsulfanyl)methyl]phenyl] N-methylcarbamate

Drug info:

PubChemData

Smile

CCSC(C1=CC=CC=C1OC(=O)NC)SCC

DOS

IR

Vibrations