Geometry & MOs

Info

ID:

423823

PubChem CID:

135120371

Reduced:

ON5C15H25 (1)

Stoich.:

AB5C15D25 (1)

Weight, g/mol:

522.211449

ΔHf, kcal/mol:

-28.35

Dipole, Da:

5.75

IP(EA), eV:

 -8.14(0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3S,7S)-13-methoxy-5-[2-(2-oxopyrrolidin-1-yl)acetyl]-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

CC1=C(N=C(N=C1N2CCC(C2)CC(=O)NC)N(C)C)C

DOS

IR

Vibrations