Geometry & MOs

Info

ID:	403114
PubChem CID:	135058803
Reduced:	ClNSO4H16C21 (1)
Stoich.:	ABCD4E16F21 (1)
Weight, g/mol:	266.108899
ΔH_f, kcal/mol:	-106.11
Dipole, Da:	7.87
IP(EA), eV:	-8.94(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-5-[(E)-prop-1-enyl]-1,2,6-thiadiazinane 1,1-dioxide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)Cl)C4=C(C2=O)C=CC(=C4)OC

DOS

IR

Vibrations