Geometry & MOs

Info

ID:	293880
PubChem CID:	117409121
Reduced:	ClNOF2C12H14 (1)
Stoich.:	ABCD2E12F14 (1)
Weight, g/mol:	261.00006
ΔH_f, kcal/mol:	-139.11
Dipole, Da:	7.2
IP(EA), eV:	-8.52(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(aminooxymethyl)-4-bromo-3-methoxy-2-methylphenol

Drug info:

PubChemData

Smile

C1CCNC(C1)CC2=C(C(=CC(=C2F)Cl)F)O

DOS

IR

Vibrations