Geometry & MOs

Info

ID:	421452
PubChem CID:	135116035
Reduced:	N2O3C19H26 (1)
Stoich.:	A2B3C19D26 (1)
Weight, g/mol:	356.1139
ΔH_f, kcal/mol:	-71.6
Dipole, Da:	3.45
IP(EA), eV:	-9.04(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-5-[(3S,4S)-3,4-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCCN2C[C@H]([C@H](C2)O)CC3=CC(=NO3)C)C

DOS

IR

Vibrations