Geometry & MOs

Info

ID:	315189
PubChem CID:	126624834
Reduced:	F3N6C19H23 (1)
Stoich.:	A3B6C19D23 (1)
Weight, g/mol:	390.177979
ΔH_f, kcal/mol:	-74.46
Dipole, Da:	5.28
IP(EA), eV:	-9.04(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-cyclopropylethyl]-4-[(E)-1-cyclopropylethylideneamino]-6-[6-(trifluoromethyl)pyridin-2-yl]-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CC(C)C(=C)NC1=NC(=NC(=N1)C2=NC(=CC=C2)C(F)(F)F)NC(=C)C(C)C

DOS

IR

Vibrations