Geometry & MOs

Info

ID:	420614
PubChem CID:	135114357
Reduced:	NO2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	508.212198
ΔH_f, kcal/mol:	-115.79
Dipole, Da:	4.58
IP(EA), eV:	-9.18(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-fluoro-23-methoxy-15-(1H-pyrrole-3-carbonyl)-2-oxa-10,15,19-triazatricyclo[19.2.2.03,8]pentacosa-1(23),3(8),4,6,21,24-hexaene-11,20-dione

Drug info:

PubChemData

Smile

C1CN(C[C@@H]1O)CC2=C(C=CC(=C2)C3=CC=CC=N3)OCC(=O)O

DOS

IR

Vibrations