Geometry & MOs

Info

ID:	67992
PubChem CID:	46507562
Reduced:	N4O4C17H20 (1)
Stoich.:	A4B4C17D20 (1)
Weight, g/mol:	452.08479
ΔH_f, kcal/mol:	-69.56
Dipole, Da:	3.84
IP(EA), eV:	-9.07(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromophenyl)-4-(3-piperidin-1-ylpyrazin-2-yl)oxybenzamide

Drug info:

PubChemData

Smile

CCOC(=O)CN1C2C(C(=O)N(C2=O)C3=CC=C(C=C3)C(C)C)N=N1

DOS

IR

Vibrations