Geometry & MOs

Info

ID:	417046
PubChem CID:	135091217
Reduced:	SO2N4C14H16 (1)
Stoich.:	AB2C4D14E16 (1)
Weight, g/mol:	403.210721
ΔH_f, kcal/mol:	-25.05
Dipole, Da:	9.31
IP(EA), eV:	-8.83(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4R,5S)-5-hydroxy-4-methyl-9-(6-oxo-1H-pyridine-2-carbonyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]cyclobutanecarboxamide

Drug info:

PubChemData

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C1[C@H]([C@@H](CN1C2=NC(=CS2)C(=O)N)O)CC3=CC=CC=N3

DOS

IR

Vibrations