Geometry & MOs

Info

ID:	415482
PubChem CID:	135088477
Reduced:	SO2N4C17H20 (1)
Stoich.:	AB2C4D17E20 (1)
Weight, g/mol:	263.126991
ΔH_f, kcal/mol:	-16.2
Dipole, Da:	4.73
IP(EA), eV:	-9.36(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(methoxymethyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]-1,3,4-oxadiazol-2-amine

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)C(=O)N2CCCN(CC2)C(=O)C3=NC=CN=C3

DOS

IR

Vibrations