Geometry & MOs

Info

ID:

430771

PubChem CID:

135170838

Reduced:

O2N6C25H26 (1)

Stoich.:

A2B6C25D26 (1)

Weight, g/mol:

465.11252

ΔHf, kcal/mol:

39.72

Dipole, Da:

5.23

IP(EA), eV:

 -9.36(-1.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-methoxyethyl 7-[(5-chloro-2-methoxyphenyl)sulfanylamino]spiro[2,5-dihydropyrido[3,2-f][1,4]oxazepine-3,1'-cyclopropane]-4-carboxylate

Drug info:

PubChemData

Smile

CCN(C1CCCC(C1)NCC2=CC3=C(C=C2)OC=N3)C(=O)C4=NC5=C(N4)C=C(C=C5)C#N

DOS

IR

Vibrations