Geometry & MOs

Info

ID:	310805
PubChem CID:	126587616
Reduced:	NSO3C19H23 (1)
Stoich.:	ABC3D19E23 (1)
Weight, g/mol:	329.14495
ΔH_f, kcal/mol:	-76.27
Dipole, Da:	3.2
IP(EA), eV:	-8.44(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-methyl N-[2-[(4-ethyl-2-methylphenoxy)methyl]-6-methylphenyl]carbamothioate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C(=CC=C2)OC)NC(=S)OC)C

DOS

IR

Vibrations