Geometry & MOs

Info

ID:	395066
PubChem CID:	135024558
Reduced:	O5C8H14 (1)
Stoich.:	A5B8C14 (1)
Weight, g/mol:	297.129969
ΔH_f, kcal/mol:	-208.54
Dipole, Da:	1.82
IP(EA), eV:	-10.18(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methylsulfanylphenyl)phenyl]-pyrrolidin-1-yldiazene

Drug info:

PubChemData

Smile

CO[C@H](/C=C/C(=O)OC)[C@@H](CO)O

DOS

IR

Vibrations