Geometry & MOs

Info

ID:	200229
PubChem CID:	79366553
Reduced:	BrFO5C13H14 (1)
Stoich.:	ABC5D13E14 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	-234.39
Dipole, Da:	4.3
IP(EA), eV:	-9.12(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-N-(3-methoxy-2-methylpropyl)-2,3-dihydro-1H-inden-1-amine

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C1=CC2=C(C(=C1)Br)OCCO2)O)F

DOS

IR

Vibrations