Geometry & MOs

Info

ID:	231877
PubChem CID:	87574837
Reduced:	SN2O2C14H14 (1)
Stoich.:	AB2C2D14E14 (1)
Weight, g/mol:	498.107038
ΔH_f, kcal/mol:	-32.43
Dipole, Da:	4.67
IP(EA), eV:	-8.42(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-(2-ethynyl-3,6-dihydro-2H-pyridin-1-yl)methanone;pyridine

Drug info:

PubChemData

Smile

CC(=O)SOC1=CC(=CC(=C1)N)C2=CC(=CC=C2)N

DOS

IR

Vibrations