Geometry & MOs

Info

ID:	343671
PubChem CID:	127266847
Reduced:	NSO4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	253.077265
ΔH_f, kcal/mol:	-110.49
Dipole, Da:	6.33
IP(EA), eV:	-9.7(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)S(=O)(=O)NCC#CCO

DOS

IR

Vibrations