Geometry & MOs

Info

ID:

259266

PubChem CID:

103162356

Reduced:

NO3C17H21 (1)

Stoich.:

AB3C17D21 (1)

Weight, g/mol:

272.116092

ΔHf, kcal/mol:

-115.41

Dipole, Da:

4.6

IP(EA), eV:

-9.24(-0.83)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

7-(2-cyclobutylacetyl)-1,5-dihydro-1,5-benzodiazepine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)C2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations