Geometry & MOs

Info

ID:	57221
PubChem CID:	22395500
Reduced:	O3H6C7 (2)
Stoich.:	A3B6C7 (2)
Weight, g/mol:	359.053505
ΔH_f, kcal/mol:	-132.68
Dipole, Da:	1.21
IP(EA), eV:	-9.87(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-acetamido-4-ethoxycarbonyl-1-phosphonopent-4-en-2-yl)phosphonic acid

Drug info:

PubChemData

Smile

CC(=C)C(=O)OCCC1=C(C(=CC=C1)C(=O)[O-])C(=O)[O-]

DOS

IR

Vibrations