Geometry & MOs

Info

ID:	360642
PubChem CID:	127301287
Reduced:	N3O3C16H21 (1)
Stoich.:	A3B3C16D21 (1)
Weight, g/mol:	325.109627
ΔH_f, kcal/mol:	-100.2
Dipole, Da:	4.59
IP(EA), eV:	-9.28(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-yl)methylamino]oxan-4-yl]methanol

Drug info:

PubChemData

Smile

CC1=CC=CN2C1=NC(=CC2=O)CNC3(CCOCC3)CO

DOS

IR

Vibrations