Geometry & MOs

Info

ID:	238552
PubChem CID:	92741875
Reduced:	FO3N4C28H31 (1)
Stoich.:	AB3C4D28E31 (1)
Weight, g/mol:	458.231791
ΔH_f, kcal/mol:	-140.58
Dipole, Da:	3.08
IP(EA), eV:	-8.49(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)NC1=C2C(=O)N([C@](CN2C3=CC=CC=C31)(C)C(=O)NC4CCCCC4)CC5=CC=C(C=C5)F

DOS

IR

Vibrations