Geometry & MOs

Info

ID:	269998
PubChem CID:	103621833
Reduced:	O2N3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	408.91744
ΔH_f, kcal/mol:	-45.52
Dipole, Da:	6.12
IP(EA), eV:	-8.85(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-iodo-N-(oxan-4-yl)benzamide

Drug info:

PubChemData

Smile

CN1C=CC(=CC1=O)C(=O)N2CCN(CC2)CC3CC3

DOS

IR

Vibrations