Geometry & MOs

Info

ID:

295483

PubChem CID:

117530530

Reduced:

O2N5C10H13 (1)

Stoich.:

A2B5C10D13 (1)

Weight, g/mol:

219.11201

ΔHf, kcal/mol:

27.58

Dipole, Da:

6.6

IP(EA), eV:

-8.94(-0.74)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[2-(4-methoxy-3-methylphenyl)tetrazol-5-yl]methanamine

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)N2N=C(N=N2)CN)OC

DOS

IR

Vibrations