Geometry & MOs

Info

ID:	295539
PubChem CID:	117533070
Reduced:	ON2C5H6 (2)
Stoich.:	AB2C5D6 (2)
Weight, g/mol:	259.14331
ΔH_f, kcal/mol:	13.6
Dipole, Da:	4.01
IP(EA), eV:	-9.39(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-5-(pyrrolidin-3-ylmethyl)tetrazole

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)N2C(=NN=N2)CO

DOS

IR

Vibrations