Geometry & MOs

Info

ID:	201073
PubChem CID:	79486234
Reduced:	SN3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	253.150036
ΔH_f, kcal/mol:	45.38
Dipole, Da:	1.54
IP(EA), eV:	-8.65(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-1-[methyl(2-thiophen-2-ylethyl)amino]pentan-3-one

Drug info:

PubChemData

Smile

CCNCC1=C(N=CC=C1)N(C)C(C)CC2=CC=CS2

DOS

IR

Vibrations