Geometry & MOs

Info

ID:	348599
PubChem CID:	127273710
Reduced:	SO2N5C17H21 (1)
Stoich.:	AB2C5D17E21 (1)
Weight, g/mol:	347.166748
ΔH_f, kcal/mol:	-1.42
Dipole, Da:	7.66
IP(EA), eV:	-9.46(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylmethyl)-N-[(1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-yl)methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CN1C(=CC=N1)C2CCCN(C2)CC3=NS(=O)(=O)C4=CC=CC=C4N3

DOS

IR

Vibrations