Geometry & MOs

Info

ID:	348580
PubChem CID:	127273691
Reduced:	ON6C16H28 (1)
Stoich.:	AB6C16D28 (1)
Weight, g/mol:	321.151098
ΔH_f, kcal/mol:	-8.57
Dipole, Da:	5.09
IP(EA), eV:	-8.84(0.22)
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,2-dimethylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)CN2CCN(CC2)CCN3C=NC=N3

DOS

IR

Vibrations