Geometry & MOs

Info

ID:	321455
PubChem CID:	126666078
Reduced:	NO4C9H13 (1)
Stoich.:	AB4C9D13 (1)
Weight, g/mol:	271.128054
ΔH_f, kcal/mol:	-127.64
Dipole, Da:	2.19
IP(EA), eV:	-10.79(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]tetrazol-1-yl]acetic acid

Drug info:

PubChemData

Smile

CCCC1=NOC(=C1C(=O)OC)CO

DOS

IR

Vibrations