Geometry & MOs

Info

ID:	16644
PubChem CID:	474346
Reduced:	SN3O5C25H35 (1)
Stoich.:	AB3C5D25E35 (1)
Weight, g/mol:	489.229742
ΔH_f, kcal/mol:	-189.47
Dipole, Da:	5.0
IP(EA), eV:	-9.02(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-3-[cyclopentylmethyl-(4-methoxyphenyl)sulfonylamino]-2-hydroxypropyl]-1-(2-phenylethyl)urea

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)S(=O)(=O)N(CC2CCCC2)C[C@H](CN(CCC3=CC=CC=C3)C(=O)N)O

DOS

IR

Vibrations