Geometry & MOs

Info

ID:	398816
PubChem CID:	135035577
Reduced:	NO7H21C23 (1)
Stoich.:	AB7C21D23 (1)
Weight, g/mol:	326.03723
ΔH_f, kcal/mol:	-219.23
Dipole, Da:	6.14
IP(EA), eV:	-8.94(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-hydroperoxy-2-methylpropane;1-methyl-3H-indol-3-ide;palladium

Drug info:

PubChemData

Smile

CC1(O[C@@H]2[C@H](C=C3[C@H]([C@@H]2O1)N(C(=O)C4=CC5=C(C=C34)OCO5)C6=CC=C(C=C6)O)O)C

DOS

IR

Vibrations