Geometry & MOs

Info

ID:	338310
PubChem CID:	127259002
Reduced:	NSC4H8 (2)
Stoich.:	ABC4D8 (2)
Weight, g/mol:	322.087495
ΔH_f, kcal/mol:	13.85
Dipole, Da:	2.63
IP(EA), eV:	-8.83(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2-methoxyphenoxy)-4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CSC(=N)CCCCC(=N)SC

DOS

IR

Vibrations