Geometry & MOs

Info

ID:	211142
PubChem CID:	80901728
Reduced:	ClN6C11H15 (1)
Stoich.:	AB6C11D15 (1)
Weight, g/mol:	264.144707
ΔH_f, kcal/mol:	74.14
Dipole, Da:	1.31
IP(EA), eV:	-9.11(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3,5-dimethyl-1,2,4-triazol-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine

Drug info:

PubChemData

Smile

CCC1=C(N=CN=C1N2C(=C(C(=N2)C)Cl)C)NN

DOS

IR

Vibrations