Geometry & MOs

Info

ID:	255136
PubChem CID:	103130248
Reduced:	ON2C11H20 (1)
Stoich.:	AB2C11D20 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	-39.98
Dipole, Da:	2.21
IP(EA), eV:	-9.21(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,4-trimethyl-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol

Drug info:

PubChemData

Smile

CCCCCC(C)(C1=NN(C=C1)C)O

DOS

IR

Vibrations