Geometry & MOs

Info

ID:	444569
PubChem CID:	135262884
Reduced:	NO3C14H15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	295.087829
ΔH_f, kcal/mol:	-92.13
Dipole, Da:	7.32
IP(EA), eV:	-9.54(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(1-ethyl-2,2-dioxo-3H-2,1-benzothiazol-5-yl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC(=O)N1CC2=C(C1)C=C(C=C2)C3(CC3)C(=O)O

DOS

IR

Vibrations