Geometry & MOs

Info

ID:	189100
PubChem CID:	77818817
Reduced:	SO4C13H16 (1)
Stoich.:	AB4C13D16 (1)
Weight, g/mol:	410.184172
ΔH_f, kcal/mol:	-156.98
Dipole, Da:	5.01
IP(EA), eV:	-8.9(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-(1,3-dioxoisoindol-2-yl)-3-(4-methoxyphenyl)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(CSCC1=CC=CC=C1)(C(=O)O)C(=O)OC

DOS

IR

Vibrations