Geometry & MOs

Info

ID:	289738
PubChem CID:	104371819
Reduced:	BrClN2O2H14C15 (1)
Stoich.:	ABC2D2E14F15 (1)
Weight, g/mol:	324.043233
ΔH_f, kcal/mol:	-46.42
Dipole, Da:	2.16
IP(EA), eV:	-9.63(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-5-(2-chlorophenyl)-3-(2,2-dimethylcyclopropyl)-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1(CC1N2C(=O)C(=C(NC2=O)Cl)C3=CC=C(C=C3)Br)C

DOS

IR

Vibrations