Geometry & MOs

Info

ID:

179381

PubChem CID:

76474170

Reduced:

NO3C17H17 (2)

Stoich.:

AB3C17D17 (2)

Weight, g/mol:

445.221286

ΔHf, kcal/mol:

-195.88

Dipole, Da:

1.61

IP(EA), eV:

 -8.85(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1,3-dimethoxy-2-oxopyrrolidin-3-yl)-(15-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-3,5,10(17)-trien-8-yl)carbamic acid

Drug info:

PubChemData

Smile

CCCC(C(=O)O)(C(=O)OC(CC1=CC2=CC=CC=C2C=C1)CC(=O)N)NC(=O)C3=CC=CC(=C3)CC4=CC=CC=C4

DOS

IR

Vibrations