Geometry & MOs

Info

ID:	124244
PubChem CID:	50876100
Reduced:	N2O2S3C14H18 (1)
Stoich.:	A2B2C3D14E18 (1)
Weight, g/mol:	376.037391
ΔH_f, kcal/mol:	-38.43
Dipole, Da:	5.05
IP(EA), eV:	-9.23(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,3-thiazole

Drug info:

PubChemData

Smile

CC1CCCCN1S(=O)(=O)C2=CC=C(S2)C3=CSC(=N3)C

DOS

IR

Vibrations