Geometry & MOs

Info

ID:	352991
PubChem CID:	127284112
Reduced:	SN2O3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	393.135842
ΔH_f, kcal/mol:	-108.83
Dipole, Da:	2.87
IP(EA), eV:	-9.16(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[4-(1,1-dioxothiolan-3-yl)piperazine-1-carbonyl]-2-methyl-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C1C(=O)N3CCN(CC3)C4CCS(=O)(=O)C4

DOS

IR

Vibrations