Geometry & MOs

Info

ID:	398992
PubChem CID:	135036806
Reduced:	O5C12H20 (1)
Stoich.:	A5B12C20 (1)
Weight, g/mol:	290.128311
ΔH_f, kcal/mol:	-252.46
Dipole, Da:	4.29
IP(EA), eV:	-10.04(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[(E)-3-diethoxyphosphorylprop-2-enyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1(OC[C@H](O1)C[C@H](C[C@H]2CCC(=O)O2)O)C

DOS

IR

Vibrations