Geometry & MOs

Info

ID:	382567
PubChem CID:	134973813
Reduced:	NO3C11H15 (1)
Stoich.:	AB3C11D15 (1)
Weight, g/mol:	360.23006
ΔH_f, kcal/mol:	-122.51
Dipole, Da:	3.2
IP(EA), eV:	-8.91(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-2-[(4-methoxyphenyl)methoxy]non-3-ynoxy]oxane

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C2NC1[C@H](CO)O)O

DOS

IR

Vibrations