Geometry & MOs

Info

ID:	254233
PubChem CID:	103123601
Reduced:	O2N6C11H16 (1)
Stoich.:	A2B6C11D16 (1)
Weight, g/mol:	276.133474
ΔH_f, kcal/mol:	13.37
Dipole, Da:	7.79
IP(EA), eV:	-9.85(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[5-(1-methylpyrazol-3-yl)tetrazol-1-yl]methyl]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CN1C(=NN=N1)C2=NN(C=C2)C

DOS

IR

Vibrations