Geometry & MOs

Info

ID:	356188
PubChem CID:	127291224
Reduced:	SN3O3C18H23 (1)
Stoich.:	AB3C3D18E23 (1)
Weight, g/mol:	381.208613
ΔH_f, kcal/mol:	-116.22
Dipole, Da:	6.82
IP(EA), eV:	-9.07(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-(3,3-dimethylbutanoyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CSCC2C(=O)NC3CCCC4=C3C=CC(=O)N4

DOS

IR

Vibrations