Geometry & MOs

Info

ID:	233381
PubChem CID:	89854497
Reduced:	NO4H13C20 (1)
Stoich.:	AB4C13D20 (1)
Weight, g/mol:	232.082347
ΔH_f, kcal/mol:	-80.72
Dipole, Da:	3.54
IP(EA), eV:	-8.65(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-amino-2-(trifluoromethyl)phenyl]azetidin-3-ol

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)O)C4=CC=C(C=C4)O

DOS

IR

Vibrations