Geometry & MOs

Info

ID:	67644
PubChem CID:	46506887
Reduced:	N2S2O6C19H20 (1)
Stoich.:	A2B2C6D19E20 (1)
Weight, g/mol:	380.184841
ΔH_f, kcal/mol:	-195.74
Dipole, Da:	8.0
IP(EA), eV:	-8.67(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4-yl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)OC)CS(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations