Geometry & MOs

Info

ID:	403440
PubChem CID:	135060318
Reduced:	SN2H18C21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	268.121178
ΔH_f, kcal/mol:	79.55
Dipole, Da:	2.33
IP(EA), eV:	-8.21(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-methoxy-4,9-dimethylpyrido[2,3-b]indol-2-yl)ethanone

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C3=C(C4=C(CCC5=CC=CC=C54)N=C31)SC

DOS

IR

Vibrations