Geometry & MOs

Info

ID:	211386
PubChem CID:	80942898
Reduced:	O2N6C11H12 (1)
Stoich.:	A2B6C11D12 (1)
Weight, g/mol:	248.118573
ΔH_f, kcal/mol:	69.14
Dipole, Da:	5.91
IP(EA), eV:	-9.44(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[(3-fluorophenyl)methyl]-6-hydrazinylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1[N+](=O)[O-])NCC2=CC=NC=C2)NN

DOS

IR

Vibrations