Geometry & MOs

Info

ID:	371471
PubChem CID:	127346535
Reduced:	NSO4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	290.174276
ΔH_f, kcal/mol:	-151.34
Dipole, Da:	3.07
IP(EA), eV:	-9.71(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxolan-3-yl)-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]acetamide

Drug info:

PubChemData

Smile

C1COCC1CC(=O)NC2CS(=O)(=O)C3=CC=CC=C23

DOS

IR

Vibrations