Geometry & MOs

Info

ID:	285682
PubChem CID:	104118377
Reduced:	ON3C14H27 (1)
Stoich.:	AB3C14D27 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-40.8
Dipole, Da:	1.43
IP(EA), eV:	-8.48(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(3,3-dimethylpyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CCCNCC1=COC(=N1)N(CC)CC(C)CC

DOS

IR

Vibrations