Geometry & MOs

Info

ID:	196532
PubChem CID:	78845348
Reduced:	NO2F3S3H10C15 (1)
Stoich.:	AB2C3D3E10F15 (1)
Weight, g/mol:	278.210661
ΔH_f, kcal/mol:	-160.08
Dipole, Da:	3.56
IP(EA), eV:	-8.99(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-N-(3-methyl-2-morpholin-4-ylbutyl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=CC=C1SC2=NC3=C(S2)C=CC(=C3)C(F)(F)F

DOS

IR

Vibrations