Geometry & MOs

Info

ID:	238557
PubChem CID:	92741893
Reduced:	N4O4C25H28 (1)
Stoich.:	A4B4C25D28 (1)
Weight, g/mol:	488.242356
ΔH_f, kcal/mol:	-118.08
Dipole, Da:	4.27
IP(EA), eV:	-8.17(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-10-acetamido-N-cyclopentyl-2-[(4-methoxyphenyl)methyl]-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)NC4CCCC4)CC5=CC=CO5

DOS

IR

Vibrations