Geometry & MOs

Info

ID:	144882
PubChem CID:	53427611
Reduced:	OC5H8 (2)
Stoich.:	AB5C8 (2)
Weight, g/mol:	338.242122
ΔH_f, kcal/mol:	-73.93
Dipole, Da:	4.24
IP(EA), eV:	-9.91(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-difluoro-3-[4-(4-propylcyclohexyl)cyclohexyl]cyclohexa-2,4-dien-1-ol

Drug info:

PubChemData

Smile

C(CCC=O)CC=CCCC=O

DOS

IR

Vibrations