Geometry & MOs

Info

ID:	245493
PubChem CID:	99445266
Reduced:	NS2O3C17H25 (1)
Stoich.:	AB2C3D17E25 (1)
Weight, g/mol:	382.111791
ΔH_f, kcal/mol:	-107.03
Dipole, Da:	2.76
IP(EA), eV:	-8.72(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]-N-ethyl-N-[(2S)-1-methoxypropan-2-yl]acetamide

Drug info:

PubChemData

Smile

CCN([C@H](C)COC)C(=O)COC1=CC=C(C=C1)C2SCCS2

DOS

IR

Vibrations