Geometry & MOs

Info

ID:	219400
PubChem CID:	85148362
Reduced:	S3N5O5H17C18 (1)
Stoich.:	A3B5C5D17E18 (1)
Weight, g/mol:	479.176644
ΔH_f, kcal/mol:	-55.15
Dipole, Da:	4.26
IP(EA), eV:	-9.2(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[3-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methoxyphenoxy]propoxy]-2,3-dihydro-1H-inden-1-yl]acetic acid

Drug info:

PubChemData

Smile

CON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)CC4=CC=CS4)C(=O)O

DOS

IR

Vibrations