Geometry & MOs

Info

ID:	254792
PubChem CID:	103127718
Reduced:	SN3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	272.109568
ΔH_f, kcal/mol:	82.83
Dipole, Da:	2.29
IP(EA), eV:	-8.62(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methylthiophen-2-yl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]ethanamine

Drug info:

PubChemData

Smile

CCNC(C1=C2C=CC=CN2N=C1)C3=C(C=CS3)C

DOS

IR

Vibrations