Geometry & MOs

Info

ID:	254595
PubChem CID:	103126382
Reduced:	NC6H7 (3)
Stoich.:	AB6C7 (3)
Weight, g/mol:	346.04292
ΔH_f, kcal/mol:	60.1
Dipole, Da:	3.49
IP(EA), eV:	-8.55(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-2-methoxyphenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CC(C2=NN(C3=CC=CC=C32)C)N)C

DOS

IR

Vibrations