Geometry & MOs

Info

ID:	294874
PubChem CID:	117501777
Reduced:	BrNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	315.04701
ΔH_f, kcal/mol:	-122.6
Dipole, Da:	4.45
IP(EA), eV:	-9.61(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-4-cyclopentyloxy-5-methoxyphenyl)methyl]hydroxylamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C(=C1C(C(=O)O)N)OC)C(C)C)Br

DOS

IR

Vibrations