Geometry & MOs

Info

ID:	340259
PubChem CID:	127262270
Reduced:	OC4H6 (3)
Stoich.:	AB4C6 (3)
Weight, g/mol:	370.178024
ΔH_f, kcal/mol:	-91.34
Dipole, Da:	0.71
IP(EA), eV:	-9.22(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl [2,5-dimethoxy-4-(1-phenylprop-2-enyl)phenyl] carbonate

Drug info:

PubChemData

Smile

CC(=CCC[C@@](C)(C#C)OC(=O)OC)C

DOS

IR

Vibrations