Geometry & MOs

Info

ID:	203637
PubChem CID:	79853287
Reduced:	OCl2C14H18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	284.165541
ΔH_f, kcal/mol:	-66.9
Dipole, Da:	3.69
IP(EA), eV:	-9.39(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chloro-5-ethyl-2-methylpyrazol-3-yl)methyl]-2,2-dimethylcyclohexan-1-ol

Drug info:

PubChemData

Smile

CC1(CCCCC1(C2=C(C(=CC=C2)Cl)Cl)O)C

DOS

IR

Vibrations