Geometry & MOs

Info

ID:	13267
PubChem CID:	224677
Reduced:	SN2O4C12H14 (1)
Stoich.:	AB2C4D12E14 (1)
Weight, g/mol:	282.067428
ΔH_f, kcal/mol:	-161.67
Dipole, Da:	7.22
IP(EA), eV:	-9.16(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(2-carbamoylsulfanylacetyl)amino]benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC(=O)N

DOS

IR

Vibrations