Geometry & MOs

Info

ID:	121137
PubChem CID:	50756921
Reduced:	O2N4C27H34 (1)
Stoich.:	A2B4C27D34 (1)
Weight, g/mol:	432.216141
ΔH_f, kcal/mol:	-39.67
Dipole, Da:	5.12
IP(EA), eV:	-8.27(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-7-methoxy-3-methyl-1-oxo-2-(pyridin-3-ylmethyl)-4H-pyrazino[1,2-a]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C1(CN2C3=CC=CC=C3C=C2C(=O)N1CC4=CC=C(C=C4)N(C)C)C

DOS

IR

Vibrations