Geometry & MOs

Info

ID:

27429

PubChem CID:

821310

Reduced:

O2C15H24 (1)

Stoich.:

A2B15C24 (1)

Weight, g/mol:

282.136828

ΔHf, kcal/mol:

-109.31

Dipole, Da:

3.91

IP(EA), eV:

-9.76(0.87)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[3-methyl-4-(propanoylamino)phenyl]benzamide

Drug info:

PubChemData

Smile

C[C@@]12CCC[C@@]([C@H]1[C@H]3[C@@H](C3(C)C)C(=O)C2)(C)O

DOS

IR

Vibrations