Geometry & MOs

Info

ID:	149362
PubChem CID:	53789034
Reduced:	NO2F3H6C9 (1)
Stoich.:	AB2C3D6E9 (1)
Weight, g/mol:	328.08266
ΔH_f, kcal/mol:	-134.15
Dipole, Da:	2.04
IP(EA), eV:	-8.69(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-bromo-1-phenylbutyl)-2,3-dihydro-1H-indene

Drug info:

PubChemData

Smile

C1C(O1)(C(F)(F)F)N2C3C=CC=C2C3=O

DOS

IR

Vibrations