Geometry & MOs

Info

ID:	286720
PubChem CID:	104222131
Reduced:	N5C15H21 (1)
Stoich.:	A5B15C21 (1)
Weight, g/mol:	285.195346
ΔH_f, kcal/mol:	59.04
Dipole, Da:	3.18
IP(EA), eV:	-8.65(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(6-methylpyridin-2-yl)methyl]-5-(propylaminomethyl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCNCC1=CN=C(N=C1)N(C)CC2=CC=CC(=N2)C

DOS

IR

Vibrations