Geometry & MOs

Info

ID:	250376
PubChem CID:	103096117
Reduced:	N2O3C8H14 (1)
Stoich.:	A2B3C8D14 (1)
Weight, g/mol:	312.01095
ΔH_f, kcal/mol:	-76.68
Dipole, Da:	4.04
IP(EA), eV:	-10.42(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(3-bromo-4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]propan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)COCC)O

DOS

IR

Vibrations