Geometry & MOs

Info

ID:	164857
PubChem CID:	74462223
Reduced:	SN3O4C13H24 (1)
Stoich.:	AB3C4D13E24 (1)
Weight, g/mol:	316.202502
ΔH_f, kcal/mol:	-165.33
Dipole, Da:	6.68
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.758239
Charge, e:	1

Chem-info

IUPAC name:

cyclopentyl-[(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-methylazanium

Drug info:

PubChemData

Smile

CC1CC[NH+](CC1)CN2C(=O)C(NC2=O)CCS(=O)(=O)C

DOS

IR

Vibrations