Geometry & MOs

Info

ID:	15894
PubChem CID:	454651
Reduced:	OS2N3H21C24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	431.112605
ΔH_f, kcal/mol:	59.4
Dipole, Da:	1.99
IP(EA), eV:	-8.65(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-bis[(2-methyl-1,3-thiazol-4-yl)methyl]-1-phenylindol-2-one

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CC2(C3=CC=CC=C3N(C2=O)C4=CC=CC=C4)CC5=CSC(=N5)C

DOS

IR

Vibrations