Geometry & MOs

Info

ID:	138672
PubChem CID:	52405588
Reduced:	NSO4C18H23 (1)
Stoich.:	ABC4D18E23 (1)
Weight, g/mol:	350.145285
ΔH_f, kcal/mol:	-139.26
Dipole, Da:	4.52
IP(EA), eV:	-8.42(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

naphthalen-1-yl-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)OCCOC)C)C

DOS

IR

Vibrations