Geometry & MOs

Info

ID:	286718
PubChem CID:	104222128
Reduced:	N5C16H23 (1)
Stoich.:	A5B16C23 (1)
Weight, g/mol:	257.164046
ΔH_f, kcal/mol:	57.96
Dipole, Da:	1.75
IP(EA), eV:	-8.53(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCNCC1=CN=C(N=C1)N(CC)CC2=CC=CC=N2

DOS

IR

Vibrations