Geometry & MOs

Info

ID:	238508
PubChem CID:	92741682
Reduced:	N4O5C27H32 (1)
Stoich.:	A4B5C27D32 (1)
Weight, g/mol:	482.289306
ΔH_f, kcal/mol:	-161.41
Dipole, Da:	6.56
IP(EA), eV:	-7.8(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-10-acetamido-N-cyclohexyl-8-methoxy-3-methyl-2-(3-methylbutyl)-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)OC)(C)C(=O)NC4CCCCC4)CC5=CC=CO5

DOS

IR

Vibrations