Geometry & MOs

Info

ID:	270632
PubChem CID:	103637398
Reduced:	ClNO2C13H20 (1)
Stoich.:	ABC2D13E20 (1)
Weight, g/mol:	301.06774
ΔH_f, kcal/mol:	-91.84
Dipole, Da:	5.18
IP(EA), eV:	-8.72(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-6-[(5-methoxypentylamino)methyl]phenol

Drug info:

PubChemData

Smile

COCCCCCNCC1=C(C=CC(=C1)Cl)O

DOS

IR

Vibrations