Geometry & MOs

Info

ID:	372248
PubChem CID:	131294668
Reduced:	F2N2O3C8H8 (1)
Stoich.:	A2B2C3D8E8 (1)
Weight, g/mol:	243.031869
ΔH_f, kcal/mol:	-141.46
Dipole, Da:	9.04
IP(EA), eV:	-9.48(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-2-(difluoromethoxy)-6-(trifluoromethyl)phenol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1[N+](=O)[O-])OC(F)F)N

DOS

IR

Vibrations