Geometry & MOs

Info

ID:	268850
PubChem CID:	103601224
Reduced:	N2O2C17H26 (1)
Stoich.:	A2B2C17D26 (1)
Weight, g/mol:	352.98989
ΔH_f, kcal/mol:	-75.71
Dipole, Da:	3.64
IP(EA), eV:	-8.78(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-bromo-2-(4-methoxy-2-nitrophenoxy)phenyl]methanol

Drug info:

PubChemData

Smile

CCC(C)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C

DOS

IR

Vibrations