Geometry & MOs

Info

ID:

418799

PubChem CID:

135106824

Reduced:

N3O5C21H25 (1)

Stoich.:

A3B5C21D25 (1)

Weight, g/mol:

534.211449

ΔHf, kcal/mol:

-157.73

Dipole, Da:

3.05

IP(EA), eV:

 -9.32(-1.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3S,7S)-5-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)-13-methoxy-2,15-dioxa-5,8,18-triazatetracyclo[18.2.2.110,14.03,7]pentacosa-1(23),10(25),11,13,20(24),21-hexaene-9,17-dione

Drug info:

PubChemData

Smile

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)N(CCO)CC3=CN=CN3C

DOS

IR

Vibrations