Geometry & MOs

Info

ID:	379943
PubChem CID:	134964385
Reduced:	OC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	255.125929
ΔH_f, kcal/mol:	-86.94
Dipole, Da:	1.28
IP(EA), eV:	-9.14(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-methylanilino)oxy-1-phenylpropan-1-one

Drug info:

PubChemData

Smile

CCO[C@H]1CC[C@@]2(O1)CCC3=CC=CC=C23

DOS

IR

Vibrations