Geometry & MOs

Info

ID:	174928
PubChem CID:	75833268
Reduced:	NS2O5C17H19 (1)
Stoich.:	AB2C5D17E19 (1)
Weight, g/mol:	298.131742
ΔH_f, kcal/mol:	-180.8
Dipole, Da:	5.99
IP(EA), eV:	-9.42(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-3-(2-methoxyphenyl)urea

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC(=C(C=C1)NC2C(CC3=CC=CC=C23)O)S(=O)(=O)C

DOS

IR

Vibrations