Geometry & MOs

Info

ID:	234580
PubChem CID:	92303108
Reduced:	SN4O4H8C13 (1)
Stoich.:	AB4C4D8E13 (1)
Weight, g/mol:	345.027555
ΔH_f, kcal/mol:	33.09
Dipole, Da:	4.64
IP(EA), eV:	-9.73(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5Z)-5-(dimethylaminomethylidene)-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=NN2C(=O)/C(=C/C3=CC=CC=C3[N+](=O)[O-])/N=C2SC1=O

DOS

IR

Vibrations