Geometry & MOs

Info

ID:	309603
PubChem CID:	126550599
Reduced:	FO2N6H27C28 (1)
Stoich.:	AB2C6D27E28 (1)
Weight, g/mol:	223.201751
ΔH_f, kcal/mol:	15.59
Dipole, Da:	10.05
IP(EA), eV:	-8.65(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-4,6-bis(2-deuteriopropan-2-yl)-1,3,5-triazine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C2=C3CC[C@H](C3=C(C=C2)F)NC4=NC=C(C=C4)C5C[C@@H]5C(=O)O)C)C6=NN(N=N6)C

DOS

IR

Vibrations