Geometry & MOs

Info

ID:	347411
PubChem CID:	127272260
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	302.199428
ΔH_f, kcal/mol:	-39.7
Dipole, Da:	5.39
IP(EA), eV:	-8.8(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cyclohexylethyl)-3-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]urea

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=CC(=C2)CNC(=O)N3CCC(CC3)C4=NC=CS4

DOS

IR

Vibrations