Geometry & MOs

Info

ID:	289260
PubChem CID:	104342095
Reduced:	ON4C15H26 (1)
Stoich.:	AB4C15D26 (1)
Weight, g/mol:	292.226312
ΔH_f, kcal/mol:	-48.82
Dipole, Da:	3.54
IP(EA), eV:	-8.95(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-N-methyl-6-(4-propan-2-ylazepan-1-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)NC2CCC(CC2C)C)N

DOS

IR

Vibrations