Geometry & MOs

Info

ID:	321592
PubChem CID:	126666654
Reduced:	FN3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	335.06332
ΔH_f, kcal/mol:	6.21
Dipole, Da:	3.54
IP(EA), eV:	-9.02(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-4-N-[(2R,4R)-2-methyloxan-4-yl]quinoline-3,4-diamine

Drug info:

PubChemData

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C1C[C@@H](C[C@@H]1C2=NC3=CC=CC=C3C4=C2NC=N4)F

DOS

IR

Vibrations