Geometry & MOs

Info

ID:	326313
PubChem CID:	126687317
Reduced:	ON2C9H16 (1)
Stoich.:	AB2C9D16 (1)
Weight, g/mol:	199.148476
ΔH_f, kcal/mol:	-43.56
Dipole, Da:	3.7
IP(EA), eV:	-9.92(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-hexan-3-yl-1,2-dihydropyrimidin-6-amine

Drug info:

PubChemData

Smile

CCC[C@@H](C)N(CC#N)C(=O)C

DOS

IR

Vibrations