Geometry & MOs

Info

ID:	403410
PubChem CID:	135060126
Reduced:	N3O4H13C19 (1)
Stoich.:	A3B4C13D19 (1)
Weight, g/mol:	292.084792
ΔH_f, kcal/mol:	-0.45
Dipole, Da:	5.42
IP(EA), eV:	-9.11(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(furan-2-yl)-5H-pyrido[4,3-b]indole-4-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C2C(=CN=C1C3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4N2

DOS

IR

Vibrations