Geometry & MOs

Info

ID:	379950
PubChem CID:	134964392
Reduced:	NBr2H11C15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	218.147079
ΔH_f, kcal/mol:	55.49
Dipole, Da:	4.27
IP(EA), eV:	-8.62(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-4-(3-propan-2-ylcyclohexen-1-yl)benzene

Drug info:

PubChemData

Smile

CC1=C(C2=C(N1)C=C(C=C2)Br)C3=CC=C(C=C3)Br

DOS

IR

Vibrations