Geometry & MOs

Info

ID:	194469
PubChem CID:	78541328
Reduced:	N3O3C13H16 (1)
Stoich.:	A3B3C13D16 (1)
Weight, g/mol:	379.114376
ΔH_f, kcal/mol:	-62.31
Dipole, Da:	5.13
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.067784
Charge, e:	0

Chem-info

IUPAC name:

N'-[(2-ethoxyphenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]oxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1O)C=C2C(=O)NC(=[N+]2C)N

DOS

IR

Vibrations