Geometry & MOs

Info

ID:	291598
PubChem CID:	113446363
Reduced:	N2C7H9 (2)
Stoich.:	A2B7C9 (2)
Weight, g/mol:	264.023645
ΔH_f, kcal/mol:	88.02
Dipole, Da:	1.86
IP(EA), eV:	-8.5(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorothiophen-2-yl)methyl]pyrazolo[1,5-a]pyrazin-4-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN2C=CN=C(C2=C1)NCCC#C

DOS

IR

Vibrations