Geometry & MOs

Info

ID:	181469
PubChem CID:	76747742
Reduced:	O2N5C15H17 (1)
Stoich.:	A2B5C15D17 (1)
Weight, g/mol:	388.05349
ΔH_f, kcal/mol:	-14.14
Dipole, Da:	1.85
IP(EA), eV:	-8.81(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(2-amino-4,5-dihydro-1,3-oxazol-4-yl)ethyl]phenyl]-6-bromopyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1C(N=C(O1)N)CCC2=CC=C(C=C2)NC(=O)C3=CN=CN3

DOS

IR

Vibrations