Geometry & MOs

Info

ID:	422647
PubChem CID:	135118186
Reduced:	N2O3C25H30 (1)
Stoich.:	A2B3C25D30 (1)
Weight, g/mol:	323.184506
ΔH_f, kcal/mol:	-71.08
Dipole, Da:	4.25
IP(EA), eV:	-8.24(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S,4S)-3,4-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]-2-(2-methylimidazol-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)OCCN2C[C@H]([C@H](C2)O)CC3=CC=NC4=CC=CC=C34

DOS

IR

Vibrations