Geometry & MOs

Info

ID:	43650
PubChem CID:	10321592
Reduced:	ClO2F3N5H17C20 (1)
Stoich.:	AB2C3D5E17F20 (1)
Weight, g/mol:	451.118651
ΔH_f, kcal/mol:	-101.1
Dipole, Da:	7.07
IP(EA), eV:	-8.64(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-chloro-3-ethoxycarbonyloxy-2-methyl-1-phenylcarbazole-9-carboxylate

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C(CN=C2C=CC(=C(N2O)CC(=O)NCC3=C(C=CC=N3)F)Cl)(F)F

DOS

IR

Vibrations