Geometry & MOs

Info

ID:	284073
PubChem CID:	104032960
Reduced:	N2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	267.098332
ΔH_f, kcal/mol:	45.48
Dipole, Da:	4.15
IP(EA), eV:	-8.28(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[[3-(trifluoromethyl)phenyl]methyl]pyridine-2,4-diamine

Drug info:

PubChemData

Smile

CCCNC1=NC=CC(=C1)N(C)CCC2=CC=CC=N2

DOS

IR

Vibrations