Geometry & MOs

Info

ID:	22599
PubChem CID:	597898
Reduced:	NOH10C11 (2)
Stoich.:	ABC10D11 (2)
Weight, g/mol:	344.152478
ΔH_f, kcal/mol:	-18.36
Dipole, Da:	3.31
IP(EA), eV:	-8.3(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(1H-indol-3-yl)-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1CCC(C2=C1NC3=CC=CC=C32)C4=CNC5=CC=CC=C54

DOS

IR

Vibrations