Geometry & MOs

Info

ID:	34124
PubChem CID:	7889947
Reduced:	N2F3O4H15C17 (1)
Stoich.:	A2B3C4D15E17 (1)
Weight, g/mol:	302.087827
ΔH_f, kcal/mol:	-213.87
Dipole, Da:	6.74
IP(EA), eV:	-9.81(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylcarbamoyl)-2-[4-(trifluoromethyl)phenoxy]acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)COC2=CC=C(C=C2)C(F)(F)F)C

DOS

IR

Vibrations