Geometry & MOs

Info

ID:	134850
PubChem CID:	51768057
Reduced:	N2O3C22H34 (1)
Stoich.:	A2B3C22D34 (1)
Weight, g/mol:	424.233763
ΔH_f, kcal/mol:	-134.77
Dipole, Da:	4.0
IP(EA), eV:	-9.21(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-(cyclohexylamino)-2-oxo-1-[4-(trifluoromethyl)phenyl]ethyl]-N-methylcyclohexanecarboxamide

Drug info:

PubChemData

Smile

C/C=C\[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(C)C(=O)C1=CC=CC=C1OC

DOS

IR

Vibrations