Geometry & MOs

Info

ID:	53574
PubChem CID:	14716719
Reduced:	O4C39H54 (1)
Stoich.:	A4B39C54 (1)
Weight, g/mol:	376.14018
ΔH_f, kcal/mol:	-177.94
Dipole, Da:	1.19
IP(EA), eV:	-8.47(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-bromophenyl)-1-(4-propylcyclohexen-1-yl)cyclohexan-1-ol

Drug info:

PubChemData

Smile

CCCCCCCCCCOC1=CC=C(C=C1)CCC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OC(C)CCCCCC

DOS

IR

Vibrations