Geometry & MOs

Info

ID:	174053
PubChem CID:	75715838
Reduced:	N2O3C19H30 (1)
Stoich.:	A2B3C19D30 (1)
Weight, g/mol:	479.166805
ΔH_f, kcal/mol:	-138.59
Dipole, Da:	3.46
IP(EA), eV:	-8.82(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexylamino)-2-oxo-1-[4-(trifluoromethyl)phenyl]ethyl]-2-hydroxy-N-methyl-5-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)(C)CC(C)(C)NC(=O)C(C1=CC=C(C=C1)OC)N(C)C=O

DOS

IR

Vibrations