Geometry & MOs

Info

ID:	347384
PubChem CID:	127272233
Reduced:	SO2N3H19C20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	372.114378
ΔH_f, kcal/mol:	-5.46
Dipole, Da:	4.41
IP(EA), eV:	-8.77(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3-(6-methylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)urea

Drug info:

PubChemData

Smile

C1CC1C2=NC3=C(S2)C=C(C=C3)NC(=O)N[C@@H]4[C@@H](CC5=CC=CC=C45)O

DOS

IR

Vibrations