Geometry & MOs

Info

ID:	159774
PubChem CID:	57288736
Reduced:	NC2S2O3H5 (1)
Stoich.:	AB2C2D3E5 (1)
Weight, g/mol:	340.26136
ΔH_f, kcal/mol:	-114.03
Dipole, Da:	3.81
IP(EA), eV:	-9.43(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butan-2-yl 2-(4-cyclononyloxybutyl)oxirane-2-carboxylate

Drug info:

PubChemData

Smile

CS(=O)(=O)N(C=O)S

DOS

IR

Vibrations