Geometry & MOs

Info

ID:	210615
PubChem CID:	80830894
Reduced:	ClN7C11H16 (1)
Stoich.:	AB7C11D16 (1)
Weight, g/mol:	276.231397
ΔH_f, kcal/mol:	67.24
Dipole, Da:	3.41
IP(EA), eV:	-9.2(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-ethyl-4-methylpiperidin-1-yl)-N-methyl-5-propan-2-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)Cl)N(C)CC2=NC=CN2C

DOS

IR

Vibrations