Geometry & MOs

Info

ID:	167349
PubChem CID:	74812791
Reduced:	FO2N4C23H35 (1)
Stoich.:	AB2C4D23E35 (1)
Weight, g/mol:	411.185472
ΔH_f, kcal/mol:	-116.42
Dipole, Da:	4.38
IP(EA), eV:	-8.58(0.14)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(3-naphthalen-1-ylpyrazolidin-4-yl)methyl-[2-(4-sulfamoylphenyl)ethyl]azanium

Drug info:

PubChemData

Smile

C1CC(OC1)CNC(=O)CCC2CCN(CC2)CC3CNNC3C4=CC(=CC=C4)F

DOS

IR

Vibrations