Geometry & MOs

Info

ID:

420208

PubChem CID:

135111835

Reduced:

N2O3C19H24 (1)

Stoich.:

A2B3C19D24 (1)

Weight, g/mol:

579.25154

ΔHf, kcal/mol:

-83.73

Dipole, Da:

4.69

IP(EA), eV:

 -9.21(0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-20-methoxy-11-propan-2-yl-15-(4,5,6,7-tetrahydro-2-benzothiophene-1-carbonyl)-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

CC1=CC(=C(C=C1)C)CC(=O)N2C[C@H]([C@H](C2)O)CC3=CC(=NO3)C

DOS

IR

Vibrations