Geometry & MOs

Info

ID:	255918
PubChem CID:	103135622
Reduced:	NSO6C13H17 (1)
Stoich.:	ABC6D13E17 (1)
Weight, g/mol:	315.077658
ΔH_f, kcal/mol:	-234.27
Dipole, Da:	4.65
IP(EA), eV:	-10.14(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methyloxolan-2-yl)methoxy]-5-sulfamoylbenzoic acid

Drug info:

PubChemData

Smile

CC1CCC(O1)COC2=C(C=C(C=C2)C(=O)O)S(=O)(=O)N

DOS

IR

Vibrations