Geometry & MOs

Info

ID:	271216
PubChem CID:	103648024
Reduced:	FON3C12H14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	-11.24
Dipole, Da:	1.76
IP(EA), eV:	-9.57(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dimethoxyphenyl)methyl]-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNCC2=CC=C(C=C2)F

DOS

IR

Vibrations