Geometry & MOs

Info

ID:	142311
PubChem CID:	53015426
Reduced:	NOSC13H17 (1)
Stoich.:	ABCD13E17 (1)
Weight, g/mol:	195.071785
ΔH_f, kcal/mol:	-19.77
Dipole, Da:	3.36
IP(EA), eV:	-9.01(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

C=CCNC(=O)C1=CSC2=C1CCCCC2

DOS

IR

Vibrations