Geometry & MOs

Info

ID:	419174
PubChem CID:	135107675
Reduced:	SN6C17H24 (1)
Stoich.:	AB6C17D24 (1)
Weight, g/mol:	365.177313
ΔH_f, kcal/mol:	71.66
Dipole, Da:	4.92
IP(EA), eV:	-8.59(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-(1,3-dihydroisoindol-2-yl)butanoyl]piperidin-4-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=NN=C(S1)CN2CCCC3(C2)CCC4=CN=C(N=C34)N(C)C

DOS

IR

Vibrations