Geometry & MOs

Info

ID:	360570
PubChem CID:	127301215
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	395.141596
ΔH_f, kcal/mol:	-59.49
Dipole, Da:	2.47
IP(EA), eV:	-8.97(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-4H-1lambda6,2,4-benzothiadiazine 1,1-dioxide

Drug info:

PubChemData

Smile

C1CCC2C(C1)N(CCO2)C(=O)CN3CCC(CC3)C4=NC5=CC=CC=C5N4

DOS

IR

Vibrations