Geometry & MOs

Info

ID:	238522
PubChem CID:	92741720
Reduced:	N4O4C27H38 (1)
Stoich.:	A4B4C27D38 (1)
Weight, g/mol:	492.253669
ΔH_f, kcal/mol:	-167.09
Dipole, Da:	6.96
IP(EA), eV:	-7.68(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-10-acetamido-8-fluoro-3-methyl-N-(3-methylbutyl)-1-oxo-2-(2-phenylethyl)-4H-pyrazino[1,2-a]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)[C@]1(CN2C3=C(C=C(C=C3)OC)C(=C2C(=O)N1C4CCCCC4)NC(=O)C)C

DOS

IR

Vibrations