Geometry & MOs

Info

ID:	373293
PubChem CID:	131312802
Reduced:	SO2C11H12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	250.97573
ΔH_f, kcal/mol:	-71.49
Dipole, Da:	2.67
IP(EA), eV:	-8.51(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-(difluoromethoxy)-2-methylaniline

Drug info:

PubChemData

Smile

CSC1=C2CC(=O)CCC2=C(C=C1)O

DOS

IR

Vibrations