Geometry & MOs

Info

ID:	160270
PubChem CID:	57309616
Reduced:	Br2O2N4C23H32 (1)
Stoich.:	A2B2C4D23E32 (1)
Weight, g/mol:	300.072177
ΔH_f, kcal/mol:	-72.27
Dipole, Da:	2.97
IP(EA), eV:	-8.15(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-phenylmethoxy-6-(trifluoromethyl)pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(CC1=CC=CC=C1Br)(C(CN)N)C(CC2=CC=CC=C2Br)(N)N

DOS

IR

Vibrations