Geometry & MOs

Info

ID:	238509
PubChem CID:	92741683
Reduced:	N4O4C27H38 (1)
Stoich.:	A4B4C27D38 (1)
Weight, g/mol:	470.25292
ΔH_f, kcal/mol:	-177.69
Dipole, Da:	1.56
IP(EA), eV:	-7.98(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-10-acetamido-N-cyclohexyl-8-methoxy-2-(2-methoxyethyl)-3-methyl-1-oxo-4H-pyrazino[1,2-a]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCN1C(=O)C2=C(C3=C(N2C[C@@]1(C)C(=O)NC4CCCCC4)C=CC(=C3)OC)NC(=O)C

DOS

IR

Vibrations