Geometry & MOs

Info

ID:	414078
PubChem CID:	135087032
Reduced:	N3O4C14H15 (1)
Stoich.:	A3B4C14D15 (1)
Weight, g/mol:	256.084792
ΔH_f, kcal/mol:	-2.56
Dipole, Da:	9.39
IP(EA), eV:	-9.0(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-methyl-4-oxo-1,9-dihydropyrido[2,3-b]indole-3-carboxylate

Drug info:

PubChemData

Smile

C/C(=N\O)/C1=C(C2=CC=CC=C2N1COC)/C=C/[N+](=O)[O-]

DOS

IR

Vibrations