Geometry & MOs

Info

ID:	437146
PubChem CID:	135215190
Reduced:	S2C7O10H14 (1)
Stoich.:	A2B7C10D14 (1)
Weight, g/mol:	237.15175
ΔH_f, kcal/mol:	-418.19
Dipole, Da:	6.88
IP(EA), eV:	-10.54(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,5-trimethyl-3-phenyl-2,3-dihydroindole

Drug info:

PubChemData

Smile

CC1C(C(C(CO1)OC)OS(=O)(=O)O)OS(=O)(=O)O

DOS

IR

Vibrations