Geometry & MOs

Info

ID:	266396
PubChem CID:	103564523
Reduced:	O2C13H18 (1)
Stoich.:	A2B13C18 (1)
Weight, g/mol:	228.102941
ΔH_f, kcal/mol:	-78.66
Dipole, Da:	3.58
IP(EA), eV:	-8.64(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chloro-2,5-dimethylpyrazol-3-yl)methyl]-3-methylcyclobutan-1-ol

Drug info:

PubChemData

Smile

CC1CC(C1)(CC2=CC(=CC=C2)OC)O

DOS

IR

Vibrations