Geometry & MOs

Info

ID:	291705
PubChem CID:	113460160
Reduced:	OC8H12 (2)
Stoich.:	AB8C12 (2)
Weight, g/mol:	340.00297
ΔH_f, kcal/mol:	-99.64
Dipole, Da:	3.61
IP(EA), eV:	-9.43(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-(3-chloro-2-methyl-3-phenylpropyl)-2-fluorobenzene

Drug info:

PubChemData

Smile

CC(CCCC1CCCO1)C(C2=CC=CC=C2)O

DOS

IR

Vibrations