Geometry & MOs

Info

ID:	309648
PubChem CID:	126551861
Reduced:	O5C24H30 (1)
Stoich.:	A5B24C30 (1)
Weight, g/mol:	358.24835
ΔH_f, kcal/mol:	-193.76
Dipole, Da:	4.51
IP(EA), eV:	-9.0(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[4-(trifluoromethoxy)cyclohexyl]cyclohex-3-en-1-yl]cyclooctane

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1C)OCCCCOC2=CC(=CC=C2)OC=O)C(=O)CC(C)C

DOS

IR

Vibrations