Geometry & MOs

Info

ID:	217716
PubChem CID:	85088262
Reduced:	O2C5H6 (4)
Stoich.:	A2B5C6 (4)
Weight, g/mol:	392.169585
ΔH_f, kcal/mol:	-339.14
Dipole, Da:	3.72
IP(EA), eV:	-9.73(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[2-[[4-(N'-hydroxycarbamimidoyl)benzoyl]amino]propanoyl]piperidin-4-yl]oxyacetic acid

Drug info:

PubChemData

Smile

CC(=O)OCC1(CC2C(C(C1)OC(=O)C)OC(O2)C3=CC=CC=C3)OC(=O)C

DOS

IR

Vibrations