Geometry & MOs

Info

ID:	427737
PubChem CID:	135161859
Reduced:	ClNSO3C19H28 (1)
Stoich.:	ABCD3E19F28 (1)
Weight, g/mol:	365.231456
ΔH_f, kcal/mol:	-122.9
Dipole, Da:	6.52
IP(EA), eV:	-8.62(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[6-[ethoxy(hydroxy)methyl]-6-azaspiro[3.4]octan-2-yl]piperidin-4-yl]pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC1=C([C@@H]2C(CCC(=O)[C@@]2(S1=O)[C@H]([C@H]3CCCC=C3)O)NC)CCCl

DOS

IR

Vibrations