Geometry & MOs

Info

ID:	151003
PubChem CID:	53790700
Reduced:	N2O5C18H24 (1)
Stoich.:	A2B5C18D24 (1)
Weight, g/mol:	488.032363
ΔH_f, kcal/mol:	-111.63
Dipole, Da:	5.02
IP(EA), eV:	-8.58(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-amino-3-(trifluoromethyl)phenyl]sulfonylamino]-2-phenoxybenzenesulfonic acid

Drug info:

PubChemData

Smile

CCN(C(=O)C1C=C(NO1)C2=CC(=C(C=C2)OC)OC3CCCC3)O

DOS

IR

Vibrations