Geometry & MOs

Info

ID:	276358
PubChem CID:	103822418
Reduced:	ON4C14H14 (1)
Stoich.:	AB4C14D14 (1)
Weight, g/mol:	217.085127
ΔH_f, kcal/mol:	72.92
Dipole, Da:	4.07
IP(EA), eV:	-9.31(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(1-aminocyclopropyl)-1,2,4-oxadiazol-3-yl]phenol

Drug info:

PubChemData

Smile

CC[C@@H](C1=NC(=NO1)C2=NC=CC3=CC=CC=C32)N

DOS

IR

Vibrations