Geometry & MOs

Info

ID:	286892
PubChem CID:	104223415
Reduced:	ON5C12H17 (1)
Stoich.:	AB5C12D17 (1)
Weight, g/mol:	261.15896
ΔH_f, kcal/mol:	43.41
Dipole, Da:	4.38
IP(EA), eV:	-9.01(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-5-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)OC2=NC=C(C=N2)CNC

DOS

IR

Vibrations