Geometry & MOs

Info

ID:	262803
PubChem CID:	103318510
Reduced:	FN4H13C15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	327.03711
ΔH_f, kcal/mol:	55.85
Dipole, Da:	1.41
IP(EA), eV:	-8.88(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-7-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

Drug info:

PubChemData

Smile

C1CN=C2C3=C(NN2C1C4=CC=C(C=C4)F)N=CC=C3

DOS

IR

Vibrations