Geometry & MOs

Info

ID:	76489
PubChem CID:	48424993
Reduced:	F3N3O3C20H26 (1)
Stoich.:	A3B3C3D20E26 (1)
Weight, g/mol:	371.156909
ΔH_f, kcal/mol:	-252.98
Dipole, Da:	6.09
IP(EA), eV:	-8.61(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

imidazo[1,2-a]pyrimidin-2-yl-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CCOC1=CC2=C(C=C1)C=C(N2)C(=O)N3CCN(CC3)CCCOCC(F)(F)F

DOS

IR

Vibrations