Geometry & MOs

Info

ID:	423437
PubChem CID:	135119500
Reduced:	N2O5C20H26 (1)
Stoich.:	A2B5C20D26 (1)
Weight, g/mol:	353.231456
ΔH_f, kcal/mol:	-142.58
Dipole, Da:	6.28
IP(EA), eV:	-8.39(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-hydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl)-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)N2C[C@H]([C@@H](C2)O)CC3=CC(=NO3)C)OCC

DOS

IR

Vibrations