Geometry & MOs

Info

ID:	381317
PubChem CID:	134972013
Reduced:	SO2C14H18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	271.986781
ΔH_f, kcal/mol:	-67.95
Dipole, Da:	3.94
IP(EA), eV:	-9.32(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-2-azido-3-(2,6-dichloropyridin-3-yl)prop-2-enoate

Drug info:

PubChemData

Smile

C[C@@H]1CSC(=O)C(C1C)OCC2=CC=CC=C2

DOS

IR

Vibrations