Geometry & MOs

Info

ID:	207873
PubChem CID:	80464723
Reduced:	ON3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	355.94827
ΔH_f, kcal/mol:	60.99
Dipole, Da:	3.12
IP(EA), eV:	-9.79(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromophenyl)-4,6-dichloro-2-(1-methylcyclopropyl)pyrimidine

Drug info:

PubChemData

Smile

CC1(CC1)C2=NOC(=N2)C(C3=CC=CC=C3)N

DOS

IR

Vibrations