Geometry & MOs

Info

ID:	352820
PubChem CID:	127283909
Reduced:	SO2N3C21H31 (1)
Stoich.:	AB2C3D21E31 (1)
Weight, g/mol:	383.166748
ΔH_f, kcal/mol:	-93.79
Dipole, Da:	1.63
IP(EA), eV:	-8.8(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-naphthalen-1-yl-2-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C)NC(=O)CN2CCCC2C(=O)N3CCSCC3)C

DOS

IR

Vibrations