Geometry & MOs

Info

ID:	403320
PubChem CID:	135059721
Reduced:	NO3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-70.54
Dipole, Da:	4.66
IP(EA), eV:	-9.11(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-3-(9-methylpyrido[2,3-b]indol-3-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CN(C(=O)CCC(C1=CC2=CC=CC=C2C=C1)O)OC

DOS

IR

Vibrations