Geometry & MOs

Info

ID:	235005
PubChem CID:	92303864
Reduced:	SN2O2C21H30 (1)
Stoich.:	AB2C2D21E30 (1)
Weight, g/mol:	374.202799
ΔH_f, kcal/mol:	-96.23
Dipole, Da:	7.46
IP(EA), eV:	-8.89(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4S)-2-cyclohexyl-3-(4-methylbenzoyl)-N-propyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)[C@H]1CS[C@@H](N1C(=O)C2=CC=C(C=C2)C)C3CCCCC3

DOS

IR

Vibrations