Geometry & MOs

Info

ID:	64053
PubChem CID:	29195904
Reduced:	O2N3C22H25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	490.107769
ΔH_f, kcal/mol:	-4.37
Dipole, Da:	5.38
IP(EA), eV:	-8.47(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-5-nitrophenyl)-2-[(5S)-2-(2,5-dimethylphenyl)imino-3-(2-methoxyethyl)-4-oxo-1,3-thiazolidin-5-yl]acetamide

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)C1=CN(N=C1C2=CC=C(C=C2)OC)CC3=CC=CC=C3

DOS

IR

Vibrations