Geometry & MOs

Info

ID:	285422
PubChem CID:	104104321
Reduced:	NSO2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	245.141579
ΔH_f, kcal/mol:	-44.9
Dipole, Da:	4.01
IP(EA), eV:	-8.9(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxazinan-2-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone

Drug info:

PubChemData

Smile

C1CCON(C1)C(=O)CCCC2=CC=CS2

DOS

IR

Vibrations