Geometry & MOs

Info

ID:	386701
PubChem CID:	134982586
Reduced:	ClNO5C18H22 (1)
Stoich.:	ABC5D18E22 (1)
Weight, g/mol:	332.0062
ΔH_f, kcal/mol:	-228.16
Dipole, Da:	4.62
IP(EA), eV:	-9.59(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-iodo-1-methyl-2-phenyl-1H-indene

Drug info:

PubChemData

Smile

CCOC(=O)C1(CC(C2=C1C=CC=C2Cl)CNC(=O)C)C(=O)OCC

DOS

IR

Vibrations