Geometry & MOs

Info

ID:	254649
PubChem CID:	103126730
Reduced:	Cl2N3H15C16 (1)
Stoich.:	A2B3C15D16 (1)
Weight, g/mol:	306.043902
ΔH_f, kcal/mol:	67.34
Dipole, Da:	5.21
IP(EA), eV:	-8.88(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

Drug info:

PubChemData

Smile

CNC(CC1=CC(=C(C=C1)Cl)Cl)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations