Geometry & MOs

Info

ID:	276197
PubChem CID:	103821193
Reduced:	OSN2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	276.093249
ΔH_f, kcal/mol:	-51.33
Dipole, Da:	5.74
IP(EA), eV:	-8.62(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(2-hydroxy-2-thiophen-3-ylethyl)-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC2CCCC(C2)SC)N

DOS

IR

Vibrations