Geometry & MOs

Info

ID:	175301
PubChem CID:	75880772
Reduced:	ON6C24H32 (1)
Stoich.:	AB6C24D32 (1)
Weight, g/mol:	442.216438
ΔH_f, kcal/mol:	25.67
Dipole, Da:	7.55
IP(EA), eV:	-9.22(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-(cyclopropylsulfamoyl)-N-[[2-[(3-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]benzamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2=CC=CC=C2CNC(=O)CCC3=C(N4C(=NC=N4)N=C3C)C

DOS

IR

Vibrations