Geometry & MOs

Info

ID:	410088
PubChem CID:	135082877
Reduced:	NSO5C14H15 (1)
Stoich.:	ABC5D14E15 (1)
Weight, g/mol:	499.02482
ΔH_f, kcal/mol:	-173.16
Dipole, Da:	7.14
IP(EA), eV:	-9.01(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CCC2=C(C1)CC(=O)OC3=C2C=CC(=C3)OS(=O)(=O)N

DOS

IR

Vibrations