Geometry & MOs

Info

ID:	430550
PubChem CID:	135170616
Reduced:	ON2F3C9H9 (1)
Stoich.:	AB2C3D9E9 (1)
Weight, g/mol:	276.108562
ΔH_f, kcal/mol:	-176.86
Dipole, Da:	4.44
IP(EA), eV:	-10.11(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[6-methyl-4-(trifluoromethyl)pyridin-3-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=N1)C(=O)NC)C(F)(F)F

DOS

IR

Vibrations