Geometry & MOs

Info

ID:	290816
PubChem CID:	111123420
Reduced:	OSN3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	288.043233
ΔH_f, kcal/mol:	3.26
Dipole, Da:	3.46
IP(EA), eV:	-8.71(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4,5-dichloro-2,3-dihydro-1H-inden-1-yl)-3-(2-hydroxyethyl)urea

Drug info:

PubChemData

Smile

CC(C)(CSC1=NC=CN1CC2=CC=CC=N2)O

DOS

IR

Vibrations