Geometry & MOs

Info

ID:	272621
PubChem CID:	103750201
Reduced:	ON2F4H8C10 (1)
Stoich.:	AB2C4D8E10 (1)
Weight, g/mol:	264.027725
ΔH_f, kcal/mol:	-194.62
Dipole, Da:	3.75
IP(EA), eV:	-10.72(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-[1-(trifluoromethyl)cyclopropyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC1(C(F)(F)F)NC(=O)C2=CN=C(C=C2)F

DOS

IR

Vibrations