Geometry & MOs

Info

ID:	429740
PubChem CID:	135169791
Reduced:	N3C6H13 (1)
Stoich.:	A3B6C13 (1)
Weight, g/mol:	298.06776
ΔH_f, kcal/mol:	25.26
Dipole, Da:	2.92
IP(EA), eV:	-8.94(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-2-(aminomethylidene)-4,4,4-trifluoro-3-pyrazolo[1,5-a]pyridin-4-yliminobutanoic acid

Drug info:

PubChemData

Smile

CC(=NC)C(=NC)NC

DOS

IR

Vibrations