Geometry & MOs

Info

ID:	372683
PubChem CID:	131302099
Reduced:	ON2H12C13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	187.048942
ΔH_f, kcal/mol:	24.36
Dipole, Da:	7.76
IP(EA), eV:	-8.74(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylsulfanyl-5-propylthiophen-2-amine

Drug info:

PubChemData

Smile

CC(C)(C#N)C1=CC2=CC=CNC2=CC1=O

DOS

IR

Vibrations