Geometry & MOs

Info

ID:	422956
PubChem CID:	135118681
Reduced:	N2O3C20H32 (1)
Stoich.:	A2B3C20D32 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-165.31
Dipole, Da:	7.75
IP(EA), eV:	-9.05(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(4R,5S)-4,5-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]methyl]-1,5-dimethylpyrrole-2-carbonitrile

Drug info:

PubChemData

Smile

C1C[C@H]([C@]2(C1)CCCN(C2)C(=O)C3CCN(CC3)C(=O)C4CCC4)O

DOS

IR

Vibrations