Geometry & MOs

Info

ID:	236200
PubChem CID:	92711894
Reduced:	ClFSN3O3H11C14 (1)
Stoich.:	ABCD3E3F11G14 (1)
Weight, g/mol:	361.073242
ΔH_f, kcal/mol:	-118.6
Dipole, Da:	5.5
IP(EA), eV:	-9.13(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[(3R)-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-3-carbonyl]amino]benzoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N[C@@H](NS2(=O)=O)C(=O)NC3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations