Geometry & MOs

Info

ID:	158970
PubChem CID:	57244323
Reduced:	NSO2H21C23 (1)
Stoich.:	ABC2D21E23 (1)
Weight, g/mol:	247.139471
ΔH_f, kcal/mol:	8.69
Dipole, Da:	1.35
IP(EA), eV:	-8.33(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(2-methylpropyl)-3-phenylthiophen-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC3=C(C=C2)C=C(S3)C4=CC=C(C=C4)OCCN

DOS

IR

Vibrations