Geometry & MOs

Info

ID:	124983
PubChem CID:	50906337
Reduced:	PO5C17H21 (1)
Stoich.:	AB5C17D21 (1)
Weight, g/mol:	292.053432
ΔH_f, kcal/mol:	-243.95
Dipole, Da:	2.81
IP(EA), eV:	-8.88(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-dimethoxyphosphoryl-3-thiophen-2-ylbutanoate

Drug info:

PubChemData

Smile

COC(=O)CC(CP(=O)(OC)OC)C1=CC2=CC=CC=C2C=C1

DOS

IR

Vibrations