Geometry & MOs

Info

ID:	238530
PubChem CID:	92741751
Reduced:	FO3N5C26H28 (1)
Stoich.:	AB3C5D26E28 (1)
Weight, g/mol:	492.217284
ΔH_f, kcal/mol:	-122.43
Dipole, Da:	5.15
IP(EA), eV:	-8.34(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-10-acetamido-N-cyclopentyl-8-fluoro-2-(4-methoxyphenyl)-3-methyl-1-oxo-4H-pyrazino[1,2-a]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C2C(=O)N([C@](CN2C3=C1C=C(C=C3)F)(C)C(=O)NC4CCCC4)CC5=CN=CC=C5

DOS

IR

Vibrations