Geometry & MOs

Info

ID:	418023
PubChem CID:	135103326
Reduced:	ON6C17H20 (1)
Stoich.:	AB6C17D20 (1)
Weight, g/mol:	534.259068
ΔH_f, kcal/mol:	56.75
Dipole, Da:	5.78
IP(EA), eV:	-8.36(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(11R)-20-methoxy-11-propan-2-yl-15-(2-pyridin-3-ylacetyl)-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=C(C=NN1C)NC(=O)CN(C)CC2=NC3=CC=CC=C3N=C2

DOS

IR

Vibrations