Geometry & MOs

Info

ID:	305437
PubChem CID:	124807248
Reduced:	N3O3C18H23 (1)
Stoich.:	A3B3C18D23 (1)
Weight, g/mol:	328.215078
ΔH_f, kcal/mol:	-107.14
Dipole, Da:	5.85
IP(EA), eV:	-9.23(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-1-benzyl-9-[(3S)-oxolan-3-yl]-1,9-diazaspiro[4.6]undecan-2-one

Drug info:

PubChemData

Smile

C1C[C@@H]2[C@@H]([C@@H](CN2C(=O)CC3=CC=CC=N3)N4CCCC4=O)OC1

DOS

IR

Vibrations