Geometry & MOs

Info

ID:	201672
PubChem CID:	79567292
Reduced:	N2O2C7H10 (1)
Stoich.:	A2B2C7D10 (1)
Weight, g/mol:	232.066635
ΔH_f, kcal/mol:	-30.37
Dipole, Da:	4.87
IP(EA), eV:	-9.64(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-fluorophenyl)-2-propoxyethanol

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)COC

DOS

IR

Vibrations