Geometry & MOs

Info

ID:	180029
PubChem CID:	76568983
Reduced:	O3N9C23H27 (1)
Stoich.:	A3B9C23D27 (1)
Weight, g/mol:	494.142897
ΔH_f, kcal/mol:	63.78
Dipole, Da:	8.98
IP(EA), eV:	-8.78(-2.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethylphenyl)-2-hydroxyimino-2-phenyl-N-[2-[2,3,6-trifluoro-4-(trifluoromethyl)phenyl]ethyl]acetamide

Drug info:

PubChemData

Smile

CC(C1=CC(=C2N=C3C=NC(=NC3=N2)C(C)(C)C)NO1)NC(=O)C4=CC(=NC=N4)N5CCOCC5

DOS

IR

Vibrations