Geometry & MOs

Info

ID:

417084

PubChem CID:

135091292

Reduced:

N2O2C7H8 (2)

Stoich.:

A2B2C7D8 (2)

Weight, g/mol:

554.254063

ΔHf, kcal/mol:

-80.89

Dipole, Da:

3.84

IP(EA), eV:

 -9.79(-1.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-fluoro-23-methoxy-15-(1-methyl-6-oxopiperidine-3-carbonyl)-2-oxa-10,15,19-triazatricyclo[19.2.2.03,8]pentacosa-1(23),3(8),4,6,21,24-hexaene-11,20-dione

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2O)C(=O)C3=CN=CC(=O)N3

DOS

IR

Vibrations