Geometry & MOs

Info

ID:	143287
PubChem CID:	53180252
Reduced:	SN3O4H13C15 (1)
Stoich.:	AB3C4D13E15 (1)
Weight, g/mol:	429.055005
ΔH_f, kcal/mol:	-72.96
Dipole, Da:	8.95
IP(EA), eV:	-9.14(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chlorophenyl)methyl]-4-(3-methoxyphenyl)-1,1-dioxopyrido[2,3-e][1,2,4]thiadiazin-3-one

Drug info:

PubChemData

Smile

CC1=NS(=O)(=O)C2=C(N1C3=CC4=C(C=C3)OCCO4)N=CC=C2

DOS

IR

Vibrations