Geometry & MOs

Info

ID:	26552
PubChem CID:	652697
Reduced:	SN2O5C21H26 (1)
Stoich.:	AB2C5D21E26 (1)
Weight, g/mol:	368.137222
ΔH_f, kcal/mol:	-168.33
Dipole, Da:	1.16
IP(EA), eV:	-9.19(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-ethyl-3-oxo-1,4-benzoxazin-4-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)NC2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)OC

DOS

IR

Vibrations