Geometry & MOs

Info

ID:	50986
PubChem CID:	12013592
Reduced:	NO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	504.206245
ΔH_f, kcal/mol:	-21.58
Dipole, Da:	3.92
IP(EA), eV:	-9.63(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,4-N,6-N-trinaphthalen-2-yl-1,3,5-triazine-2,4,6-triamine

Drug info:

PubChemData

Smile

C1CN2[C@@H](C[C@H](C1=O)O2)C3=CC=CC=C3

DOS

IR

Vibrations