Geometry & MOs

Info

ID:	132243
PubChem CID:	51329348
Reduced:	N2O5C19H26 (1)
Stoich.:	A2B5C19D26 (1)
Weight, g/mol:	396.06847
ΔH_f, kcal/mol:	-185.94
Dipole, Da:	1.6
IP(EA), eV:	-8.7(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(5-bromo-2-hydroxybenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C(=O)N3CCOCC3)OC

DOS

IR

Vibrations