Geometry & MOs

Info

ID:	22589
PubChem CID:	597848
Reduced:	NC3H6 (4)
Stoich.:	AB3C6 (4)
Weight, g/mol:	224.200097
ΔH_f, kcal/mol:	12.16
Dipole, Da:	2.93
IP(EA), eV:	-8.25(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dipentyl-1,4-dihydro-1,2,4,5-tetrazine

Drug info:

PubChemData

Smile

CCCCCC1=NNC(=NN1)CCCCC

DOS

IR

Vibrations