Geometry & MOs

Info

ID:	145660
PubChem CID:	53566039
Reduced:	SO2N3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	337.153875
ΔH_f, kcal/mol:	-57.58
Dipole, Da:	1.09
IP(EA), eV:	-9.08(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N(C)CC1=NC2=CC=CC=C2S1)N3CCCC3=O

DOS

IR

Vibrations