Geometry & MOs

Info

ID:	430204
PubChem CID:	135170267
Reduced:	FON3C24H36 (1)
Stoich.:	ABC3D24E36 (1)
Weight, g/mol:	267.169525
ΔH_f, kcal/mol:	-83.85
Dipole, Da:	2.75
IP(EA), eV:	-8.28(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylbutan-2-yl 4-(tetrazol-1-yl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)NC1=NC(=C(C2=C1CCC2)/C=C(\C(=C)CCCCN3CCCC3)/O)CF

DOS

IR

Vibrations