Geometry & MOs

Info

ID:	272424
PubChem CID:	103742816
Reduced:	ClON4C11H17 (1)
Stoich.:	ABC4D11E17 (1)
Weight, g/mol:	223.148476
ΔH_f, kcal/mol:	-22.12
Dipole, Da:	4.83
IP(EA), eV:	-9.11(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-6-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1(C(CC1OC)NC2=CC(=NC(=N2)N)Cl)C

DOS

IR

Vibrations