Geometry & MOs

Info

ID:	8676
PubChem CID:	80156
Reduced:	CNH3 (4)
Stoich.:	ABC3 (4)
Weight, g/mol:	116.106196
ΔH_f, kcal/mol:	14.74
Dipole, Da:	1.82
IP(EA), eV:	-8.9(2.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,5,7-tetrazocane

Drug info:

PubChemData

Smile

C1NCNCNCN1

DOS

IR

Vibrations