Geometry & MOs

Info

ID:	287389
PubChem CID:	104239756
Reduced:	ClFON2C15H16 (1)
Stoich.:	ABCD2E15F16 (1)
Weight, g/mol:	308.109169
ΔH_f, kcal/mol:	-46.52
Dipole, Da:	2.64
IP(EA), eV:	-9.46(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-chloro-3-cyclopentyl-1-[(4-fluorophenyl)methyl]pyrazol-4-yl]methanol

Drug info:

PubChemData

Smile

C1CCC(C1)C2=NN(C(=C2CO)Cl)C3=CC(=CC=C3)F

DOS

IR

Vibrations