Geometry & MOs

Info

ID:	46375
PubChem CID:	10524134
Reduced:	SN3O6C16H23 (1)
Stoich.:	AB3C6D16E23 (1)
Weight, g/mol:	385.188923
ΔH_f, kcal/mol:	-168.85
Dipole, Da:	5.79
IP(EA), eV:	-9.37(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(4R,5S)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-1-naphthalen-1-ylmethanimine oxide

Drug info:

PubChemData

Smile

CC(C)(C)O/N=C\1/C[C@@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)NO

DOS

IR

Vibrations