Geometry & MOs

Info

ID:	38221
PubChem CID:	8028154
Reduced:	SN2O2C12H16 (1)
Stoich.:	AB2C2D12E16 (1)
Weight, g/mol:	282.054852
ΔH_f, kcal/mol:	-48.19
Dipole, Da:	5.92
IP(EA), eV:	-8.41(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-[2-[(Z)-(carbamothioylhydrazinylidene)methyl]-6-methoxyphenoxy]acetate

Drug info:

PubChemData

Smile

CCNC(=S)NC[C@H]1COC2=CC=CC=C2O1

DOS

IR

Vibrations