Geometry & MOs

Info

ID:	258971
PubChem CID:	103157652
Reduced:	O2N3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	263.126991
ΔH_f, kcal/mol:	-23.54
Dipole, Da:	1.66
IP(EA), eV:	-9.12(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)CC2=NOC(=N2)CC(CN)OC)C

DOS

IR

Vibrations