Geometry & MOs

Info

ID:	211297
PubChem CID:	80926391
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	266.127994
ΔH_f, kcal/mol:	31.03
Dipole, Da:	4.0
IP(EA), eV:	-8.33(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydrazinyl-5-methylpyrimidin-4-yl)isoquinolin-8-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC2=C(C(=NC=N2)NN)C

DOS

IR

Vibrations