Geometry & MOs

Info

ID:	442810
PubChem CID:	135256358
Reduced:	ON8C26H26 (1)
Stoich.:	AB8C26D26 (1)
Weight, g/mol:	380.170922
ΔH_f, kcal/mol:	127.63
Dipole, Da:	8.86
IP(EA), eV:	-8.85(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[[6-(1-methoxyethyl)pyridin-2-yl]methylimino]ethanehydrazonoyl]-6-(1,3-oxazol-2-yl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=NC(=CC(=N1)C2=CN(N=N2)CC3=NC(=CC=C3)C4(CCCC4)O)C5=CC=CC(=C5)C#N

DOS

IR

Vibrations