Geometry & MOs

Info

ID:

410942

PubChem CID:

135083745

Reduced:

N2O2C12H15 (1)

Stoich.:

A2B2C12D15 (1)

Weight, g/mol:

291.000448

ΔHf, kcal/mol:

-37.1

Dipole, Da:

3.1

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.353193

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl N-phenylcarbamate;chlorozinc(1+)

Drug info:

PubChemData

Smile

CCOC(=O)N[N+]1=CC2=CC=CC=C2CC1

DOS

IR

Vibrations