Geometry & MOs

Info

ID:	387508
PubChem CID:	134985629
Reduced:	SN2O2C20H24 (1)
Stoich.:	AB2C2D20E24 (1)
Weight, g/mol:	294.140199
ΔH_f, kcal/mol:	-41.61
Dipole, Da:	6.45
IP(EA), eV:	-9.32(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-5-propan-2-yl-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-b][1,2,5]thiadiazole 1,1-dioxide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C[C@H]2CCN3C2CN(S3(=O)=O)CC4=CC=CC=C4

DOS

IR

Vibrations