Geometry & MOs

Info

ID:	296460
PubChem CID:	117575924
Reduced:	OSN4C11H14 (1)
Stoich.:	ABC4D11E14 (1)
Weight, g/mol:	225.101445
ΔH_f, kcal/mol:	25.31
Dipole, Da:	1.9
IP(EA), eV:	-9.16(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(N-methylanilino)pyrimidin-4-yl]cyanamide

Drug info:

PubChemData

Smile

C1=COC(=C1)CNC2=NC=NC(=C2)NCCS

DOS

IR

Vibrations