Geometry & MOs

Info

ID:	360652
PubChem CID:	127301297
Reduced:	ON5C19H23 (1)
Stoich.:	AB5C19D23 (1)
Weight, g/mol:	345.125946
ΔH_f, kcal/mol:	51.09
Dipole, Da:	4.12
IP(EA), eV:	-9.28(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN=C(O2)C(C)N3CCC(CC3)N4C=CN=C4

DOS

IR

Vibrations