Geometry & MOs

Info

ID:	243000
PubChem CID:	99214952
Reduced:	NO3C22H29 (1)
Stoich.:	AB3C22D29 (1)
Weight, g/mol:	357.101034
ΔH_f, kcal/mol:	-108.33
Dipole, Da:	4.48
IP(EA), eV:	-8.7(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methylthiophen-2-yl)-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=C(C=C1)OC)NC(=O)CCCCC2=CC=C(C=C2)OC

DOS

IR

Vibrations