Geometry & MOs

Info

ID:	175193
PubChem CID:	75865244
Reduced:	N2O5C16H20 (1)
Stoich.:	A2B5C16D20 (1)
Weight, g/mol:	382.093164
ΔH_f, kcal/mol:	-194.43
Dipole, Da:	5.3
IP(EA), eV:	-9.23(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-dimethyl-2,6-dioxo-1,3-diazinan-4-yl)methyl 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)OCC2CC(=O)N(C(=O)N2C)C)OC

DOS

IR

Vibrations