Geometry & MOs

Info

ID:	245697
PubChem CID:	103022976
Reduced:	ClSN3O4C10H18 (1)
Stoich.:	ABC3D4E10F18 (1)
Weight, g/mol:	267.04444
ΔH_f, kcal/mol:	-141.67
Dipole, Da:	9.46
IP(EA), eV:	-10.34(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-5-(2-methoxypropan-2-yl)-1,2,4-triazole-3-sulfonyl chloride

Drug info:

PubChemData

Smile

CC(C)(CC1=NN=C(N1CCOC)S(=O)(=O)Cl)OC

DOS

IR

Vibrations