Geometry & MOs

Info

ID:	238542
PubChem CID:	92741829
Reduced:	FN4O4C24H31 (1)
Stoich.:	AB4C4D24E31 (1)
Weight, g/mol:	456.253669
ΔH_f, kcal/mol:	-202.38
Dipole, Da:	6.56
IP(EA), eV:	-8.21(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-10-acetamido-2-[(2S)-butan-2-yl]-N-cyclohexyl-8-fluoro-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)NC4CCCCC4)CCOC

DOS

IR

Vibrations