Geometry & MOs

Info

ID:	197705
PubChem CID:	78988585
Reduced:	BrNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	315.04701
ΔH_f, kcal/mol:	-111.51
Dipole, Da:	5.54
IP(EA), eV:	-9.19(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(1-ethoxypropan-2-yl)-2-methoxybenzamide

Drug info:

PubChemData

Smile

CCN(CC1CCCO1)C(=O)C2=C(C=C(C=C2)Br)OC

DOS

IR

Vibrations