Geometry & MOs

Info

ID:	178266
PubChem CID:	76306669
Reduced:	O5N6C23H38 (1)
Stoich.:	A5B6C23D38 (1)
Weight, g/mol:	425.97075
ΔH_f, kcal/mol:	-218.47
Dipole, Da:	4.51
IP(EA), eV:	-9.5(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(5-bromothiophen-2-yl)prop-2-enoyl]-N-methyl-2,3-dihydroindole-5-sulfonamide

Drug info:

PubChemData

Smile

CCCCN1C2C(C(=O)NC1=O)N(C(=N2)CCC(=O)NC(C)C(=O)N3CCOCC3)CC(C)C

DOS

IR

Vibrations