Geometry & MOs

Info

ID:

121182

PubChem CID:

50758015

Reduced:

N2O3C18H26 (1)

Stoich.:

A2B3C18D26 (1)

Weight, g/mol:

326.143056

ΔHf, kcal/mol:

-133.09

Dipole, Da:

1.83

IP(EA), eV:

-9.12(-0.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(2-fluoro-4-methylphenyl)-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide

Drug info:

PubChemData

Smile

CCC(C(=O)NCCCOC)N1C(=O)CCCC2=CC=CC=C21

DOS

IR

Vibrations