Geometry & MOs

Info

ID:	345325
PubChem CID:	127269601
Reduced:	SN3O3C18H25 (1)
Stoich.:	AB3C3D18E25 (1)
Weight, g/mol:	366.161329
ΔH_f, kcal/mol:	-105.82
Dipole, Da:	2.83
IP(EA), eV:	-8.33(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cyclohexyloxyethyl)-3-(6-methylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)urea

Drug info:

PubChemData

Smile

CSC1=CC2=C(C=C1NC(=O)NC3CCN4C3CCCC4)OCCO2

DOS

IR

Vibrations