Geometry & MOs

Info

ID:	424345
PubChem CID:	135122313
Reduced:	N2O4C15H16 (1)
Stoich.:	A2B4C15D16 (1)
Weight, g/mol:	248.066029
ΔH_f, kcal/mol:	-115.83
Dipole, Da:	2.98
IP(EA), eV:	-9.35(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenoxy-1-(trifluoromethoxy)cyclobutan-1-ol

Drug info:

PubChemData

Smile

C=CCOC(=O)[C@H](CC1=CN(C2=CC=CC=C21)C(=O)O)N

DOS

IR

Vibrations