Geometry & MOs

Info

ID:	349184
PubChem CID:	127274910
Reduced:	SN3O3C17H21 (1)
Stoich.:	AB3C3D17E21 (1)
Weight, g/mol:	378.197714
ΔH_f, kcal/mol:	-114.21
Dipole, Da:	3.89
IP(EA), eV:	-8.86(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(1-phenylcycloheptyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCSCC2)NC(=O)C3CCC(=O)N3

DOS

IR

Vibrations