Geometry & MOs

Info

ID:	254844
PubChem CID:	103128091
Reduced:	N3C14H17 (1)
Stoich.:	A3B14C17 (1)
Weight, g/mol:	256.168797
ΔH_f, kcal/mol:	93.08
Dipole, Da:	2.31
IP(EA), eV:	-8.76(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propyl-1-pyrazolo[1,5-a]pyrazin-3-ylhex-5-yn-1-amine

Drug info:

PubChemData

Smile

CNC(CCCC#C)C1=C2C=CC=CN2N=C1

DOS

IR

Vibrations