Geometry & MOs

Info

ID:	246282
PubChem CID:	103059047
Reduced:	OF2N3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	230.199428
ΔH_f, kcal/mol:	-68.05
Dipole, Da:	3.82
IP(EA), eV:	-8.86(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[[4-(propylamino)oxan-3-yl]methyl]amino]ethanol

Drug info:

PubChemData

Smile

CCNC1=NC=C(N=C1)COC2=C(C=CC(=C2)F)F

DOS

IR

Vibrations