Geometry & MOs

Info

ID:	272328
PubChem CID:	103739815
Reduced:	NSO4C26H31 (1)
Stoich.:	ABC4D26E31 (1)
Weight, g/mol:	286.99795
ΔH_f, kcal/mol:	-152.36
Dipole, Da:	3.62
IP(EA), eV:	-8.72(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(2-ethylcyclopropyl)-4-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)C4(CC(CSC4)(C)C)C(=O)O

DOS

IR

Vibrations