Geometry & MOs

Info

ID:	279610
PubChem CID:	103844456
Reduced:	NO3C12H13 (1)
Stoich.:	AB3C12D13 (1)
Weight, g/mol:	307.061136
ΔH_f, kcal/mol:	-42.3
Dipole, Da:	3.09
IP(EA), eV:	-9.11(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(4-chloro-3-nitrophenyl)methoxy]phenyl]ethanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCO)OCC2=CC=NO2

DOS

IR

Vibrations