Geometry & MOs

Info

ID:	129835
PubChem CID:	51074010
Reduced:	OS2N4C11H16 (1)
Stoich.:	AB2C4D11E16 (1)
Weight, g/mol:	256.099397
ΔH_f, kcal/mol:	25.3
Dipole, Da:	5.53
IP(EA), eV:	-8.88(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(1-cyclopentyltetrazol-5-yl)sulfanylpropanoate

Drug info:

PubChemData

Smile

C1CC(OC1)CNC2=NN=C(S2)SCCCC#N

DOS

IR

Vibrations