Geometry & MOs

Info

ID:	287975
PubChem CID:	104303605
Reduced:	ON3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	271.168462
ΔH_f, kcal/mol:	-30.16
Dipole, Da:	1.5
IP(EA), eV:	-8.89(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethylphenyl)-2-(6-methoxypyrimidin-4-yl)-N-methylethanamine

Drug info:

PubChemData

Smile

CNC(CC1CCCC1)CC2=CC(=NC=N2)OC

DOS

IR

Vibrations