Geometry & MOs

Info

ID:	334558
PubChem CID:	127253233
Reduced:	N2O5H18C21 (1)
Stoich.:	A2B5C18D21 (1)
Weight, g/mol:	337.142641
ΔH_f, kcal/mol:	-63.77
Dipole, Da:	4.18
IP(EA), eV:	-7.9(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-[2-oxo-2-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)ethoxy]-1H-pyridin-4-one

Drug info:

PubChemData

Smile

CC1=C(N=C(N1O)C2=COC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations