Geometry & MOs

Info

ID:	43770
PubChem CID:	10321763
Reduced:	N2O5H22C24 (1)
Stoich.:	A2B5C22D24 (1)
Weight, g/mol:	454.132921
ΔH_f, kcal/mol:	-88.84
Dipole, Da:	13.0
IP(EA), eV:	-8.51(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[(4-chlorophenyl)sulfonylamino]-4-(2-pyridin-3-yloxyethyl)octanoic acid

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1/C=C/C(=O)C2=CC=C(C=C2)C(=O)O)C3=CN=C(N3)C4CC4)OC

DOS

IR

Vibrations