Geometry & MOs

Info

ID:	277990
PubChem CID:	103832480
Reduced:	O2N3H13C15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	253.102668
ΔH_f, kcal/mol:	37.3
Dipole, Da:	1.85
IP(EA), eV:	-8.77(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NCC2=NC(=NO2)C3=CC(=CC=C3)O

DOS

IR

Vibrations