Geometry & MOs

Info

ID:	348600
PubChem CID:	127273711
Reduced:	SO2N3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	370.146347
ΔH_f, kcal/mol:	-37.88
Dipole, Da:	7.74
IP(EA), eV:	-9.25(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-phenyl-1,4-diazepan-1-yl)methyl]-4H-1lambda6,2,4-benzothiadiazine 1,1-dioxide

Drug info:

PubChemData

Smile

C1CCC(CC1)CN(CC2=NS(=O)(=O)C3=CC=CC=C3N2)C4CC4

DOS

IR

Vibrations