Geometry & MOs

Info

ID:

420971

PubChem CID:

135115140

Reduced:

N2O2C15H24 (1)

Stoich.:

A2B2C15D24 (1)

Weight, g/mol:

519.248169

ΔHf, kcal/mol:

-50.97

Dipole, Da:

3.26

IP(EA), eV:

-9.09(0.22)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

20-methoxy-6,26-dimethyl-9,18-dioxa-1,13,14,15,25-pentazapentacyclo[24.2.2.113,16.119,23.03,8]dotriaconta-3(8),4,6,14,16(32),19,21,23(31)-octaene-2,24-dione

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@H]2O)CCC=C(C)C

DOS

IR

Vibrations