Geometry & MOs

Info

ID:	286717
PubChem CID:	104222127
Reduced:	N5C16H21 (1)
Stoich.:	A5B16C21 (1)
Weight, g/mol:	285.195346
ΔH_f, kcal/mol:	85.98
Dipole, Da:	2.71
IP(EA), eV:	-8.76(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-5-(propylaminomethyl)-N-(pyridin-2-ylmethyl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=N1)C2=NC=C(C=N2)CNC3CC3

DOS

IR

Vibrations