Geometry & MOs

Info

ID:	210803
PubChem CID:	80857291
Reduced:	N5C14H21 (1)
Stoich.:	A5B14C21 (1)
Weight, g/mol:	249.138974
ΔH_f, kcal/mol:	40.0
Dipole, Da:	6.11
IP(EA), eV:	-8.7(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4,5-dimethylimidazol-1-yl)-5-fluoro-N-propylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CCNC1=C(C(=NC=N1)N2C=NC(=C2C)C)C(C)C

DOS

IR

Vibrations