Geometry & MOs

Info

ID:	217165
PubChem CID:	85087357
Reduced:	N2O5H14C18 (1)
Stoich.:	A2B5C14D18 (1)
Weight, g/mol:	338.128311
ΔH_f, kcal/mol:	-83.1
Dipole, Da:	3.04
IP(EA), eV:	-8.92(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(diethoxyphosphorylmethyl)-5-phenylpenta-2,4-dienoate

Drug info:

PubChemData

Smile

[C-]#[N+]C(=CC1=CC(=C(C=C1)O)O)C(=CC2=CC(=C(C=C2)O)O)NC=O

DOS

IR

Vibrations