Geometry & MOs

Info

ID:	182380
PubChem CID:	76883722
Reduced:	ON5C13H21 (1)
Stoich.:	AB5C13D21 (1)
Weight, g/mol:	313.120861
ΔH_f, kcal/mol:	-3.05
Dipole, Da:	4.47
IP(EA), eV:	-8.98(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-aminophenyl)methyl-pyrazolidin-4-ylsulfonylamino]acetamide

Drug info:

PubChemData

Smile

CC1C(C(NN1)N)C(=O)N(C)CCC2=CC=NC=C2

DOS

IR

Vibrations