Geometry & MOs

Info

ID:	267224
PubChem CID:	103581419
Reduced:	FON2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	301.261694
ΔH_f, kcal/mol:	-48.58
Dipole, Da:	5.08
IP(EA), eV:	-9.44(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,3-dimethyloxolan-3-yl)amino]-3-(2-ethylhexoxy)propan-2-ol

Drug info:

PubChemData

Smile

CC1C(CCO1)(C)NCC2=C(C(=CC=C2)C#N)F

DOS

IR

Vibrations