Geometry & MOs

Info

ID:	266842
PubChem CID:	103579728
Reduced:	BrON2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	351.05824
ΔH_f, kcal/mol:	6.8
Dipole, Da:	2.49
IP(EA), eV:	-8.39(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-bromo-3,5-dimethylanilino)methyl]-1,3-dimethylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NCC2=C(ON=C2C)C

DOS

IR

Vibrations