Geometry & MOs

Info

ID:	211201
PubChem CID:	80909658
Reduced:	ClF2N5H10C11 (1)
Stoich.:	AB2C5D10E11 (1)
Weight, g/mol:	256.143645
ΔH_f, kcal/mol:	-18.96
Dipole, Da:	3.86
IP(EA), eV:	-8.97(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyrimidin-2-yl]hydrazine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)CNC2=NC(=NC=C2Cl)NN)F

DOS

IR

Vibrations