Geometry & MOs

Info

ID:	307827
PubChem CID:	125309638
Reduced:	ClFSO2N5H15C20 (1)
Stoich.:	ABCD2E5F15G20 (1)
Weight, g/mol:	410.199428
ΔH_f, kcal/mol:	-24.26
Dipole, Da:	3.92
IP(EA), eV:	-9.25(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-3-[(3,4-dimethoxyphenyl)-[(2R)-2-methyl-2H-indol-3-yl]methyl]-2-methyl-2H-indole

Drug info:

PubChemData

Smile

C1C(=NC(=O)NC1=O)CC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)F

DOS

IR

Vibrations