Geometry & MOs

Info

ID:	289253
PubChem CID:	104341866
Reduced:	O2N5C14H23 (1)
Stoich.:	A2B5C14D23 (1)
Weight, g/mol:	292.226312
ΔH_f, kcal/mol:	-63.88
Dipole, Da:	1.25
IP(EA), eV:	-9.0(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-6-(4-methylazepan-1-yl)-N-propylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC(=N1)COC)N2CCNC(=O)C2C

DOS

IR

Vibrations