Geometry & MOs

Info

ID:

339705

PubChem CID:

127261707

Reduced:

O2N3C14H15 (1)

Stoich.:

A2B3C14D15 (1)

Weight, g/mol:

252.111007

ΔHf, kcal/mol:

-18.44

Dipole, Da:

3.46

IP(EA), eV:

-9.64(-0.36)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[2-(4-hydroxybutanoyl)phenyl]methyl N-aminocarbamate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC2=CN=CC=C2)COC(=O)NN

DOS

IR

Vibrations