Geometry & MOs

Info

ID:	417230
PubChem CID:	135091747
Reduced:	N3O3C20H23 (1)
Stoich.:	A3B3C20D23 (1)
Weight, g/mol:	320.173607
ΔH_f, kcal/mol:	-34.99
Dipole, Da:	4.14
IP(EA), eV:	-8.12(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4R,5S)-4,5-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]-(4-methylpyridin-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C=CC=C2OC)N3C[C@H]([C@@H](C3)O)CC4=CC(=NO4)C

DOS

IR

Vibrations