Geometry & MOs

Info

ID:	169297
PubChem CID:	75086221
Reduced:	N2O3C18H18 (1)
Stoich.:	A2B3C18D18 (1)
Weight, g/mol:	210.097998
ΔH_f, kcal/mol:	-16.05
Dipole, Da:	5.52
IP(EA), eV:	-8.51(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N,N-diethyl-4,4,4-trifluorobut-2-enamide

Drug info:

PubChemData

Smile

CC(=CC1=CC=C(C=C1)OC)C2NC(=C3C=CC=CC3=O)ON2

DOS

IR

Vibrations