Geometry & MOs

Info

ID:	397296
PubChem CID:	135030009
Reduced:	NO4C21H21 (1)
Stoich.:	AB4C21D21 (1)
Weight, g/mol:	289.110279
ΔH_f, kcal/mol:	-125.05
Dipole, Da:	4.57
IP(EA), eV:	-8.87(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 11H-benzo[a]carbazole-8-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(C=C1)NC3=C(C=C(C=C23)C(=O)OCC)CC=C

DOS

IR

Vibrations