Geometry & MOs

Info

ID:	333409
PubChem CID:	127251961
Reduced:	F2O2N3C15H17 (1)
Stoich.:	A2B2C3D15E17 (1)
Weight, g/mol:	341.135111
ΔH_f, kcal/mol:	-109.12
Dipole, Da:	2.1
IP(EA), eV:	-9.29(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[2-[4-(trifluoromethyl)phenoxy]ethyl]-1H-pyrazol-3-yl]morpholine

Drug info:

PubChemData

Smile

C1COC(CN1)C2=NNC(=C2)CCOC3=CC(=C(C=C3)F)F

DOS

IR

Vibrations