Geometry & MOs

Info

ID:	159311
PubChem CID:	57269555
Reduced:	NO3C20H29 (1)
Stoich.:	AB3C20D29 (1)
Weight, g/mol:	115.085795
ΔH_f, kcal/mol:	-161.5
Dipole, Da:	5.57
IP(EA), eV:	-9.15(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-imino-3-methyltriazolidin-1-amine

Drug info:

PubChemData

Smile

C[C@@]12CCCC1=C3CCC4[C@@]([C@@H]3CC2)(CC(C(=O)N4)C(=O)OC)C

DOS

IR

Vibrations