Geometry & MOs

Info

ID:	430363
PubChem CID:	135170427
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	279.092915
ΔH_f, kcal/mol:	-46.12
Dipole, Da:	6.05
IP(EA), eV:	-9.33(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3,3-trimethylindol-5-yl)oxathiolane 2,2-dioxide

Drug info:

PubChemData

Smile

CC(=C)C(=O)NCCCNCC1=CC=C(C=C1)C=O

DOS

IR

Vibrations