Geometry & MOs

Info

ID:	26939
PubChem CID:	804554
Reduced:	SN2O3C17H26 (1)
Stoich.:	AB2C3D17E26 (1)
Weight, g/mol:	296.209993
ΔH_f, kcal/mol:	-130.17
Dipole, Da:	4.65
IP(EA), eV:	-9.62(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-(cyclohexylcarbamoyl)pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2CCCCCC2

DOS

IR

Vibrations