Geometry & MOs

Info

ID:	225046
PubChem CID:	85735839
Reduced:	NO2C12H20 (1)
Stoich.:	AB2C12D20 (1)
Weight, g/mol:	283.087829
ΔH_f, kcal/mol:	-51.35
Dipole, Da:	1.13
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.763533
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-(oxan-2-yloxy)ethanimine

Drug info:

PubChemData

Smile

C[N+](C)(C)CCCC1=C(C=CC(=C1)O)O

DOS

IR

Vibrations