Geometry & MOs

Info

ID:	305594
PubChem CID:	124961299
Reduced:	FO3N4C27H27 (1)
Stoich.:	AB3C4D27E27 (1)
Weight, g/mol:	229.132746
ΔH_f, kcal/mol:	-61.58
Dipole, Da:	5.07
IP(EA), eV:	-8.63(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-1H-pyrazol-3-yl)-6-[(2S)-pyrrolidin-2-yl]pyrazine

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C2=NNC(=C2)C(=O)N3CCC[C@@H](C3)C4=NC=C(O4)CC5=CC=C(C=C5)F

DOS

IR

Vibrations