Geometry & MOs

Info

ID:	197290
PubChem CID:	78948826
Reduced:	INSO2H12C13 (1)
Stoich.:	ABCD2E12F13 (1)
Weight, g/mol:	400.01063
ΔH_f, kcal/mol:	-16.66
Dipole, Da:	3.53
IP(EA), eV:	-8.79(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-phenylethyl]-5-iodothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)NC(=O)C2=CSC(=C2)I

DOS

IR

Vibrations