Geometry & MOs

Info

ID:	202246
PubChem CID:	79646302
Reduced:	NO2F3C9H16 (1)
Stoich.:	AB2C3D9E16 (1)
Weight, g/mol:	287.199762
ΔH_f, kcal/mol:	-273.62
Dipole, Da:	5.82
IP(EA), eV:	-9.9(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N',2,2-trimethyl-N'-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methyl]propane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C(F)(F)F)OC1CCC(C1)(CO)N

DOS

IR

Vibrations