Geometry & MOs

Info

ID:	207168
PubChem CID:	80355113
Reduced:	NSO4C14H25 (1)
Stoich.:	ABC4D14E25 (1)
Weight, g/mol:	230.064447
ΔH_f, kcal/mol:	-198.76
Dipole, Da:	5.91
IP(EA), eV:	-9.06(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloropyridin-4-yl)methylsulfanyl]-N,N-dimethylethanamine

Drug info:

PubChemData

Smile

CC1CN(CC1C(=O)OC)C2CCCC(C2)S(=O)(=O)C

DOS

IR

Vibrations