Geometry & MOs

Info

ID:	45656
PubChem CID:	10516128
Reduced:	NO2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	269.164046
ΔH_f, kcal/mol:	-22.64
Dipole, Da:	1.37
IP(EA), eV:	-7.99(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2,4-dimethylphenyl)-6-methyl-4-N-prop-2-enyl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(CC=C)C2=CC=CC=C2O

DOS

IR

Vibrations