Geometry & MOs

Info

ID:	243261
PubChem CID:	99217979
Reduced:	OSN4F6H18C20 (1)
Stoich.:	ABC4D6E18F20 (1)
Weight, g/mol:	424.118082
ΔH_f, kcal/mol:	-290.05
Dipole, Da:	2.55
IP(EA), eV:	-8.91(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)-3-propyl-N-(2,2,2-trifluoroethyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)N(CC(F)(F)F)C(=O)CC2=C(N(N=C2C)C3=CC=CC(=C3)C(F)(F)F)C

DOS

IR

Vibrations