Geometry & MOs

Info

ID:	74754
PubChem CID:	48422410
Reduced:	N2O5C22H28 (1)
Stoich.:	A2B5C22D28 (1)
Weight, g/mol:	392.111455
ΔH_f, kcal/mol:	-166.72
Dipole, Da:	2.85
IP(EA), eV:	-8.31(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]-2-(cyclopropylmethoxy)-N-methylpropanamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)CN(C)C(=O)C(CC2=CC=CC=C2)NC(=O)OC)OC

DOS

IR

Vibrations