Geometry & MOs

Info

ID:	255859
PubChem CID:	103135239
Reduced:	SO2N3C11H21 (1)
Stoich.:	AB2C3D11E21 (1)
Weight, g/mol:	259.120843
ΔH_f, kcal/mol:	-57.1
Dipole, Da:	3.13
IP(EA), eV:	-8.98(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-methyloxolan-2-yl)methyl]indole-3-carboxylic acid

Drug info:

PubChemData

Smile

CCCNC(C1=NN(C=C1)C)C(C)S(=O)(=O)C

DOS

IR

Vibrations