Geometry & MOs

Info

ID:	285397
PubChem CID:	104104196
Reduced:	O2N3C12H13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	6.38
Dipole, Da:	2.72
IP(EA), eV:	-9.17(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxazinan-2-yl)-2-phenoxybutan-1-one

Drug info:

PubChemData

Smile

C1CCON(C1)C(=O)C2=CC3=C(C=C2)NN=C3

DOS

IR

Vibrations