Geometry & MOs

Info

ID:	235118
PubChem CID:	92304067
Reduced:	SN2O2C20H22 (1)
Stoich.:	AB2C2D20E22 (1)
Weight, g/mol:	394.171499
ΔH_f, kcal/mol:	-56.8
Dipole, Da:	6.49
IP(EA), eV:	-8.64(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2S)-4-oxo-3-(2-propylphenyl)-1,3-thiazolidin-2-yl]phenyl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1=CC=C(C=C1)[C@H]2N(C(=O)CS2)C3=CC=C(C=C3)C

DOS

IR

Vibrations