Geometry & MOs

Info

ID:	357957
PubChem CID:	127295457
Reduced:	N3O3C16H29 (1)
Stoich.:	A3B3C16D29 (1)
Weight, g/mol:	323.130363
ΔH_f, kcal/mol:	-159.15
Dipole, Da:	2.88
IP(EA), eV:	-9.01(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)NC1CCCN(C1)C(=O)CN(C)CC2CCCOC2

DOS

IR

Vibrations