Geometry & MOs

Info

ID:	342701
PubChem CID:	127265861
Reduced:	ON4C14H14 (1)
Stoich.:	AB4C14D14 (1)
Weight, g/mol:	396.171893
ΔH_f, kcal/mol:	56.35
Dipole, Da:	3.52
IP(EA), eV:	-9.5(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-(1-methyl-2,6-dioxa-9-azaspiro[4.5]decan-9-yl)propylsulfonyl]phenyl]acetamide

Drug info:

PubChemData

Smile

C=CC(=O)N1CCN2C(=NN=C2C3=CC=CC=C3)C1

DOS

IR

Vibrations