Geometry & MOs

Info

ID:	231928
PubChem CID:	87574937
Reduced:	O3N4H16C17 (1)
Stoich.:	A3B4C16D17 (1)
Weight, g/mol:	460.081696
ΔH_f, kcal/mol:	0.32
Dipole, Da:	4.8
IP(EA), eV:	-8.2(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(furan-3-yl)-3-(hydroxymethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-3-(1,3-thiazol-2-yl)-2,5-dihydropyrrole-1-carbaldehyde

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=NNC3=O

DOS

IR

Vibrations