Geometry & MOs

Info

ID:	211314
PubChem CID:	80929562
Reduced:	SN7C11H17 (1)
Stoich.:	AB7C11D17 (1)
Weight, g/mol:	279.126615
ΔH_f, kcal/mol:	89.92
Dipole, Da:	4.79
IP(EA), eV:	-9.17(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-5-propylpyrimidin-4-yl]hydrazine

Drug info:

PubChemData

Smile

CC1=NN=C(N1C)SC2=NC=NC(=C2C(C)C)NN

DOS

IR

Vibrations