Geometry & MOs

Info

ID:	137059
PubChem CID:	52145815
Reduced:	NOSC18H23 (1)
Stoich.:	ABCD18E23 (1)
Weight, g/mol:	199.090509
ΔH_f, kcal/mol:	-17.55
Dipole, Da:	1.61
IP(EA), eV:	-8.71(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

methyl-[2-(methylamino)-2-oxoethyl]-(thiophen-2-ylmethyl)azanium

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C2=CN=C(O2)CSC3CCCC3

DOS

IR

Vibrations