Geometry & MOs

Info

ID:	219469
PubChem CID:	85148719
Reduced:	N2O7C28H36 (1)
Stoich.:	A2B7C28D36 (1)
Weight, g/mol:	512.107579
ΔH_f, kcal/mol:	-277.52
Dipole, Da:	4.28
IP(EA), eV:	-9.57(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[4-[3-(2-hydroxy-2-thiophen-3-ylethyl)sulfanyl-4-oxo-1-phenylazetidin-2-yl]phenoxy]acetyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)C(C(=O)OC(=O)C(C(C)C)N(C)C(=O)OCC1=CC=CC=C1)N(C)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations