Geometry & MOs

Info

ID:	347435
PubChem CID:	127272284
Reduced:	SO2N3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-23.61
Dipole, Da:	2.52
IP(EA), eV:	-8.93(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(OC2=CC=CC=C12)C(C)NC(=O)N3CCC(CC3)C4=NC=CS4

DOS

IR

Vibrations