Geometry & MOs

Info

ID:	85115
PubChem CID:	49871864
Reduced:	FN7H16C21 (1)
Stoich.:	AB7C16D21 (1)
Weight, g/mol:	291.148396
ΔH_f, kcal/mol:	95.82
Dipole, Da:	4.9
IP(EA), eV:	-9.33(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1,2-diphenylethyl)-1,2,4-triazine-3,5-diamine

Drug info:

PubChemData

Smile

CC(C1=C(C=C2C=C(C=CC2=N1)F)C3=CC=CC=N3)NC4=NC=NC(=C4C#N)N

DOS

IR

Vibrations