Geometry & MOs

Info

ID:	183233
PubChem CID:	76995465
Reduced:	N3O3C14H19 (1)
Stoich.:	A3B3C14D19 (1)
Weight, g/mol:	311.082744
ΔH_f, kcal/mol:	-69.07
Dipole, Da:	5.51
IP(EA), eV:	-8.9(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(oxan-3-ylsulfamoyl)phenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

C1CC(COC1)NC(=O)C(C2=CC=CC=C2)C(=NO)N

DOS

IR

Vibrations