Geometry & MOs

Info

ID:	66023
PubChem CID:	46488151
Reduced:	N2O5C24H30 (1)
Stoich.:	A2B5C24D30 (1)
Weight, g/mol:	330.140199
ΔH_f, kcal/mol:	-146.47
Dipole, Da:	8.33
IP(EA), eV:	-8.22(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methoxyphenyl)ethyl]-2-propan-2-ylsulfanylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=C(C=C1)OCCCC(=O)N2CCN(CC2)C3=CC=CC=C3OC)OC

DOS

IR

Vibrations