Geometry & MOs

Info

ID:	422558
PubChem CID:	135118031
Reduced:	O3N4C11H16 (1)
Stoich.:	A3B4C11D16 (1)
Weight, g/mol:	326.220557
ΔH_f, kcal/mol:	6.09
Dipole, Da:	5.73
IP(EA), eV:	-9.43(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(3S,4S)-3,4-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CN(C)CC2=NOC(=N2)COC

DOS

IR

Vibrations