Geometry & MOs

Info

ID:

422858

PubChem CID:

135118527

Reduced:

SN5C18H21 (1)

Stoich.:

AB5C18D21 (1)

Weight, g/mol:

526.253983

ΔHf, kcal/mol:

86.77

Dipole, Da:

1.04

IP(EA), eV:

 -8.52(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-20-methoxy-15-[(2R)-5-oxopyrrolidine-2-carbonyl]-11-propan-2-yl-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=CN=C1N2CCCC(C2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations