Geometry & MOs

Info

ID:	58829
PubChem CID:	24714920
Reduced:	O2N3C17H21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	328.226312
ΔH_f, kcal/mol:	23.54
Dipole, Da:	1.63
IP(EA), eV:	-8.76(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(4-methylpiperazin-1-yl)-3-phenyl-1,2-oxazol-4-yl]methyl]butan-2-amine

Drug info:

PubChemData

Smile

C1CC1NCC2=C(ON=C2C3=CC=CC=C3)N4CCOCC4

DOS

IR

Vibrations