Geometry & MOs

Info

ID:	360438
PubChem CID:	127301083
Reduced:	ON6C20H26 (1)
Stoich.:	AB6C20D26 (1)
Weight, g/mol:	377.115775
ΔH_f, kcal/mol:	40.62
Dipole, Da:	2.18
IP(EA), eV:	-9.12(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(oxan-3-ylmethyl)-5,5-dioxo-1H-[1,2,4]triazolo[5,1-c][1,2,4]benzothiadiazine-7-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)C3=CN=C4C(=C3)C=NN4CC(C)C

DOS

IR

Vibrations