Geometry & MOs

Info

ID:	265552
PubChem CID:	103529700
Reduced:	NO3F4C13H17 (1)
Stoich.:	AB3C4D13E17 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	-298.61
Dipole, Da:	6.89
IP(EA), eV:	-9.01(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(pyrimidin-2-ylmethylamino)oxan-4-yl]methanol

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)CNCC(C(F)F)(F)F)OC)OC

DOS

IR

Vibrations