Geometry & MOs

Info

ID:	348627
PubChem CID:	127273738
Reduced:	ON5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	350.177647
ΔH_f, kcal/mol:	27.41
Dipole, Da:	3.22
IP(EA), eV:	-8.9(-1.11)
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-propan-2-ylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(N=NC(=C1C#N)N2CCN(CC2)CC3CCOC3)C

DOS

IR

Vibrations