Geometry & MOs

Info

ID:	130544
PubChem CID:	51091170
Reduced:	NSO4C17H19 (1)
Stoich.:	ABC4D17E19 (1)
Weight, g/mol:	332.119464
ΔH_f, kcal/mol:	-110.74
Dipole, Da:	8.56
IP(EA), eV:	-9.43(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothiolan-3-yl)-1-methyl-N-prop-2-enylindole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(OC2=CC=CC=C12)C(=O)N(CC=C)C3CCS(=O)(=O)C3

DOS

IR

Vibrations