Geometry & MOs

Info

ID:	285409
PubChem CID:	104104250
Reduced:	SN3O3C11H11 (1)
Stoich.:	AB3C3D11E11 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-38.6
Dipole, Da:	5.52
IP(EA), eV:	-9.39(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethoxy-4-methylphenyl)-(oxazinan-2-yl)methanone

Drug info:

PubChemData

Smile

C1CCON(C1)C(=O)C2=CN=C3N(C2=O)C=CS3

DOS

IR

Vibrations