Geometry & MOs

Info

ID:	393298
PubChem CID:	135020034
Reduced:	NO4H13C19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	192.078644
ΔH_f, kcal/mol:	-20.23
Dipole, Da:	3.6
IP(EA), eV:	-9.27(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-hydroxy-2-[hydroxy(phenyl)methyl]cyclobutan-1-one

Drug info:

PubChemData

Smile

C1C(C2=C(C=CC3=CC=CC=C32)OC1=O)C4=CC=C(C=C4)[N+](=O)[O-]

DOS

IR

Vibrations