Geometry & MOs

Info

ID:	343421
PubChem CID:	127266594
Reduced:	F3N3O3C14H14 (1)
Stoich.:	A3B3C3D14E14 (1)
Weight, g/mol:	317.137556
ΔH_f, kcal/mol:	-212.48
Dipole, Da:	1.21
IP(EA), eV:	-9.65(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(5-formylpyrazolo[1,5-a]pyridine-3-carbonyl)amino]-2-methylbutanoate

Drug info:

PubChemData

Smile

CCN(CC(C(F)(F)F)O)C(=O)C1=C2C=C(C=CN2N=C1)C=O

DOS

IR

Vibrations