Geometry & MOs

Info

ID:	285416
PubChem CID:	104104308
Reduced:	NO3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	171.125929
ΔH_f, kcal/mol:	-118.88
Dipole, Da:	4.41
IP(EA), eV:	-9.25(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(oxazinan-2-yl)butan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)OCC(=O)N1CCCCO1

DOS

IR

Vibrations