Geometry & MOs

Info

ID:	308021
PubChem CID:	125311847
Reduced:	SO3N5C15H19 (1)
Stoich.:	AB3C5D15E19 (1)
Weight, g/mol:	349.120861
ΔH_f, kcal/mol:	-39.77
Dipole, Da:	4.53
IP(EA), eV:	-8.84(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3,5-dimethyl-N-[2-(1-methyl-2,2-dioxo-2lambda6,1,3-benzothiadiazol-3-yl)ethyl]-3H-pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1C(=C(N=N1)C)C(=O)NCCN2C3=CC=CC=C3N(S2(=O)=O)C

DOS

IR

Vibrations