Geometry & MOs

Info

ID:	410752
PubChem CID:	135083553
Reduced:	PO5C7H11 (1)
Stoich.:	AB5C7D11 (1)
Weight, g/mol:	236.104859
ΔH_f, kcal/mol:	-255.82
Dipole, Da:	5.38
IP(EA), eV:	-10.3(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl [(E)-3-(3-methoxyphenyl)prop-2-enyl] carbonate

Drug info:

PubChemData

Smile

CC1=C(CC(=O)O1)P(=O)(OC)OC

DOS

IR

Vibrations