Geometry & MOs

Info

ID:	337308
PubChem CID:	127256990
Reduced:	O2F3N3C12H14 (1)
Stoich.:	A2B3C3D12E14 (1)
Weight, g/mol:	261.072511
ΔH_f, kcal/mol:	-173.03
Dipole, Da:	3.61
IP(EA), eV:	-9.66(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3E)-3-hydroxyiminopropyl]-4-(trifluoromethyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCO/N=C/CCNC(=O)C1=C(C=CN=C1)C(F)(F)F

DOS

IR

Vibrations