Geometry & MOs

Info

ID:	263813
PubChem CID:	103400578
Reduced:	ClNSO2C14H16 (1)
Stoich.:	ABCD2E14F16 (1)
Weight, g/mol:	306.059362
ΔH_f, kcal/mol:	-38.63
Dipole, Da:	1.61
IP(EA), eV:	-8.37(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[amino-(3-chloro-4-methylthiophen-2-yl)methyl]-1-methyl-3H-indol-2-one

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(C2=CC(=C(C=C2)OC)OC)N

DOS

IR

Vibrations