Geometry & MOs

Info

ID:	299038
PubChem CID:	117669469
Reduced:	N3O7C19H25 (1)
Stoich.:	A3B7C19D25 (1)
Weight, g/mol:	334.03837
ΔH_f, kcal/mol:	-300.86
Dipole, Da:	1.01
IP(EA), eV:	-9.71(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[4-chloro-3-(trifluoromethyl)phenoxy]-2-(fluoromethyl)phenyl]methanol

Drug info:

PubChemData

Smile

CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(=O)O)C(=O)O

DOS

IR

Vibrations