Geometry & MOs

Info

ID:	256352
PubChem CID:	103138704
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	252.066555
ΔH_f, kcal/mol:	-45.47
Dipole, Da:	3.24
IP(EA), eV:	-9.22(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenoxy)-1-(1-methylpyrazol-3-yl)ethanol

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(CN)C2=CC=CC=C2

DOS

IR

Vibrations