Geometry & MOs

Info

ID:	434866
PubChem CID:	135175866
Reduced:	O2N3C12H19 (1)
Stoich.:	A2B3C12D19 (1)
Weight, g/mol:	214.215747
ΔH_f, kcal/mol:	-48.58
Dipole, Da:	1.94
IP(EA), eV:	-9.0(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-heptan-3-yl-1-propan-2-yltetrazolidine

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)O[C@@H]2CCN(C2)CCOC

DOS

IR

Vibrations