Geometry & MOs

Info

ID:	279763
PubChem CID:	103845071
Reduced:	ClFNOC14H21 (1)
Stoich.:	ABCDE14F21 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-113.32
Dipole, Da:	3.0
IP(EA), eV:	-9.23(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-ethylpyrazol-3-yl)methylamino]cyclohexyl]methanol

Drug info:

PubChemData

Smile

CC(C)(C)CC(CNCC1=C(C=CC(=C1)Cl)F)O

DOS

IR

Vibrations