Geometry & MOs

Info

ID:	46032
PubChem CID:	10520628
Reduced:	NO5C18H23 (1)
Stoich.:	AB5C18D23 (1)
Weight, g/mol:	333.195346
ΔH_f, kcal/mol:	-198.03
Dipole, Da:	0.99
IP(EA), eV:	-9.73(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(2,4-dimethylphenyl)-2-N-ethyl-6-methyl-2-N-phenyl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

C[C@H](C(=O)/C=C/C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

DOS

IR

Vibrations