Geometry & MOs

Info

ID:	262223
PubChem CID:	103277522
Reduced:	NOF3C15H18 (1)
Stoich.:	ABC3D15E18 (1)
Weight, g/mol:	262.204513
ΔH_f, kcal/mol:	-178.18
Dipole, Da:	2.11
IP(EA), eV:	-9.3(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethylcyclohex-3-en-1-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol

Drug info:

PubChemData

Smile

CC1CC(CC(=C1)C)C(C2=C(C=CN=C2)C(F)(F)F)O

DOS

IR

Vibrations