Geometry & MOs

Info

ID:

418659

PubChem CID:

135106510

Reduced:

N2C9H14 (2)

Stoich.:

A2B9C14 (2)

Weight, g/mol:

512.220575

ΔHf, kcal/mol:

30.06

Dipole, Da:

1.93

IP(EA), eV:

-8.46(0.13)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(11R)-20-methoxy-11-propan-2-yl-15-(1,3-thiazol-2-ylmethyl)-18-oxa-3,6,9,12,15-pentazatricyclo[17.3.1.02,6]tricosa-1(23),2,4,19,21-pentaene-10,13-dione

Drug info:

PubChemData

Smile

CN(C)C1=NC=C2CCC3(C2=N1)CCCN(C3)CC4CCC4

DOS

IR

Vibrations