Geometry & MOs

Info

ID:	374086
PubChem CID:	131323570
Reduced:	BrINOF2H5C7 (1)
Stoich.:	ABCDE2F5G7 (1)
Weight, g/mol:	266.97065
ΔH_f, kcal/mol:	-105.58
Dipole, Da:	2.46
IP(EA), eV:	-8.91(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-6-(difluoromethoxy)-4-methoxyaniline

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1Br)OC(F)F)I)N

DOS

IR

Vibrations