Geometry & MOs

Info

ID:	380836
PubChem CID:	134971405
Reduced:	ClF2N3O5H18C25 (1)
Stoich.:	AB2C3D5E18F25 (1)
Weight, g/mol:	237.122575
ΔH_f, kcal/mol:	-185.33
Dipole, Da:	6.8
IP(EA), eV:	-9.41(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-(methylaminomethyl)-8-nitro-2,3-dihydroimidazo[1,2-a]pyridin-5-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OC[C@@H]2C(C([C@@H](O2)N3C=C(C4=C3N=CN=C4Cl)F)F)OC(=O)C5=CC=CC=C5

DOS

IR

Vibrations