Geometry & MOs

Info

ID:	244590
PubChem CID:	99368085
Reduced:	BrNO3C20H24 (1)
Stoich.:	ABC3D20E24 (1)
Weight, g/mol:	366.169191
ΔH_f, kcal/mol:	-99.33
Dipole, Da:	3.2
IP(EA), eV:	-8.98(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-hydroxyphenyl)methyl]-N-propyl-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CCCN(CC1=CC=CC=C1O)C(=O)[C@H](C)OC2=C(C=C(C=C2)C)Br

DOS

IR

Vibrations